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RCR_SP_70K_SMILES-MMChat

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OpenMol 3

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][Ring2][Ring1][C]", "[N][C][C][C][N][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][Ring2][Ring1][C]" ], "smiles": [ "CC(C)(C)OC(=O)NC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1", "NC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][N][C]", "[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][Cl]", "[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][#Branch2][Cl]" ], "smiles": [ "CNC", "COC(=O)c1cc(F)c(F)cc1Cl", "COC(=O)c1cc(F)c(N(C)C)cc1Cl" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CS(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch2][Ring1][Ring1][N][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][S][Ring1][P]", "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][N][C][C][C][N][S][Ring1][#Branch2]" ], "smiles": [ "Cc1ccccc1C(=O)c1cnc(NCCCNC(=O)OC(C)(C)C)s1", "Cc1ccccc1C(=O)c1cnc(NCCCN)s1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][N][C][C][N][Ring1][=Branch1]", "[C][C][=C][Branch1][C][Cl][N][=N][C][Branch1][C][Cl][=C][Ring1][Branch2][C]", "[C][C][=C][Branch1][C][Cl][N][=N][C][Branch1][N][N][C][C][N][C][Branch1][C][C][C][Ring1][#Branch1][=C][Ring1][=C][C]" ], "smiles": [ "CC1CNCCN1", "Cc1c(Cl)nnc(Cl)c1C", "Cc1c(Cl)nnc(N2CCNC(C)C2)c1C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][N][Branch1][#C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=Branch1][C][=O][C][Ring1][#C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][Ring2][Ring1][O]", "[O][=C][N][Branch1][#C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=Branch1][C][=O][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][N][C][C][N][Ring2][Ring1][#Branch2][Ring1][=C]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCN2C(=O)N(c3cc(Cl)cc(Cl)c3)C(=O)C2(Cc2ccc(Br)cc2)C1", "O=C1N(c2cc(Cl)cc(Cl)c2)C(=O)C2(Cc3ccc(Br)cc3)CNCCN12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[O][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Branch1][C][O][C][Ring1][=Branch1]", "[C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#C]" ], "smiles": [ "CS(=O)(=O)Cl", "O=C(OCc1ccccc1)N1CCC(O)C1", "CS(=O)(=O)OC1CCN(C(=O)OCc2ccccc2)C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][I]", "[N][C][C][Branch1][C][O][C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2]", "[O][=C][Branch1][N][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][I][N][C][C][Branch1][C][O][C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2]" ], "smiles": [ "CCOC(=O)COc1ccccc1I", "NCC(O)CN1CCc2ccccc2C1", "O=C(COc1ccccc1I)NCC(O)CN1CCc2ccccc2C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][Cl]", "[C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][C][=C][C][=C][Branch1][O][C][C][N][C][C][Ring1][Branch1][C][Ring1][=Branch1][C][=C][Ring1][N][C][=Branch1][C][=O][O][Ring2][Ring1][C]", "[C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][=N][C][=C][C][=C][Branch2][Ring1][C][C][C][C][Ring1][Ring1][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Ring1][=Branch2][C][=C][Ring1][#C][C][=Branch1][C][=O][O][Ring2][Ring1][Branch1]" ], "smiles": [ "CC(=O)Cl", "CC(=O)NCC1CN(c2ccc(C34CNCC3C4)cc2)C(=O)O1", "CC(=O)NCC1CN(c2ccc(C34CC3CN(C(C)=O)C4)cc2)C(=O)O1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "ClCCl.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Si][Branch1][P][O][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C]", "[C][O][C][=Branch1][C][=O][C][C][Branch1][C][O][C][Branch1][S][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C]", "[C][O][C][=Branch1][C][=O][C][C][Branch2][Ring1][=Branch1][O][Si][Branch1][=Branch1][C][Branch1][C][C][C][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C]" ], "smiles": [ "CC(C)[Si](OS(=O)(=O)C(F)(F)F)(C(C)C)C(C)C", "COC(=O)CC(O)C(NC(=O)OCc1ccccc1)C(C)C", "COC(=O)CC(O[Si](C(C)C)(C(C)C)C(C)C)C(NC(=O)OCc1ccccc1)C(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][=C][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][N][N][=C][N][=C][Ring1][Branch1][C][=C][C][Branch1][#Branch2][C][N][C][C][N][C][C][Ring1][=Branch1][=C][N][=C][Ring1][=N][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][N]", "[C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[C][O][C][=C][C][=C][Branch2][Ring2][#C][C][N][C][=Branch1][C][=O][N][N][=C][N][=C][Ring1][Branch1][C][=C][C][Branch2][Ring1][Ring2][C][N][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][#Branch2][=C][N][=C][Ring1][P][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][S]" ], "smiles": [ "COc1ccc(Cn2c(=O)n3ncnc3c3cc(CN4CCNCC4)cnc32)cc1", "CS(=O)(=O)Cl", "COc1ccc(Cn2c(=O)n3ncnc3c3cc(CN4CCN(S(C)(=O)=O)CC4)cnc32)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CC#N .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][N][C][C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][Ring1][#C]", "[C][C][=Branch1][C][=O][N][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][C][Ring1][=N]" ], "smiles": [ "CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1", "CC(=O)N1CCN(c2ccc(N)cc2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][N]", "[C][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][N]" ], "smiles": [ "Cc1cccc([N+](=O)[O-])c1N", "Cc1cccc(N)c1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[Br][Br]", "[C][C][N][C][=N][C][Branch1][C][C][=C][C][=C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=N][=N][Ring2][Ring1][C]", "[C][C][N][C][=N][C][Branch1][C][C][=C][C][=C][Branch1][C][Br][C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=C][=N][Ring2][Ring1][Ring1]" ], "smiles": [ "BrBr", "CCNc1nc(C)c2ccc(=O)n(C3CCCCC3)c2n1", "CCNc1nc(C)c2cc(Br)c(=O)n(C3CCCCC3)c2n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CC(=O)O.ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O]", "[O][=S][=Branch1][C][=O][Branch1][C][Cl][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O]", "[O][=C][Branch1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O]" ], "smiles": [ "Nc1cc(Cl)ccc1C(=O)O", "O=S(=O)(Cl)c1ccc(Cl)c(C(F)(F)F)c1", "O=C(O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "C1COCCO1.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][C][=C][C][=C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][=C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch2]", "[O][=C][Branch1][C][O][C][C][=C][C][=C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][=C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch2]" ], "smiles": [ "COC(=O)Cc1ccc(NC(=O)c2cn(Cc3ccccc3)c3ccccc23)c(Cl)c1", "O=C(O)Cc1ccc(NC(=O)c2cn(Cc3ccccc3)c3ccccc23)c(Cl)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][Branch1][C][Cl][C][=C][N+1][Branch1][C][O-1][=C][Ring1][Branch2][C]", "[O][C][C][C][O][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][O][C][Ring1][O]", "[C][C][=C][Branch2][Ring1][Ring2][O][C][C][C][O][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][O][C][Ring1][O][C][=C][N+1][Branch1][C][O-1][=C][Ring2][Ring1][Ring2][C]" ], "smiles": [ "Cc1c(Cl)cc[n+]([O-])c1C", "OCC1COC2(CCOCC2)OC1", "Cc1c(OCC2COC3(CCOCC3)OC2)cc[n+]([O-])c1C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CS(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][=C][C][=Branch2][Ring1][=N][=C][Ring1][=Branch1][C][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][O][C][=Branch1][#C][=C][C][=N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][Ring2][Ring1][#C][=O]", "[C][O][C][=C][C][=C][C][=Branch1][=C][=C][Ring1][=Branch1][C][C][C][C][C][N][C][C][Ring1][=Branch1][O][C][=Branch1][#C][=C][C][=N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][Ring2][Ring1][Branch2][=O]" ], "smiles": [ "COc1ccc2c(c1CCC1CCN(C(=O)OC(C)(C)C)CC1)OC(=Cc1n[nH]c3ccccc13)C2=O", "COc1ccc2c(c1CCC1CCNCC1)OC(=Cc1n[nH]c3ccccc13)C2=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1COCCO1.ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2]", "[C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2]" ], "smiles": [ "CCOC(=O)C(C)(C)S(=O)(=O)c1ccc2ncsc2c1", "CC(C)(C(=O)O)S(=O)(=O)c1ccc2ncsc2c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be C1COCCO1.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][C][=C][C][=C][N][=C][Branch1][=C][N][C][=C][N][=C][Branch1][Ring1][C][#N][C][=N][Ring1][Branch2][C][=C][Ring1][#C][N][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N]", "[C][O][C][C][=C][C][=C][N][=C][Branch1][=C][N][C][=C][N][=C][Branch1][Ring1][C][#N][C][=N][Ring1][Branch2][C][=C][Ring1][#C][N][C][C][C][C][N][C][C][Ring1][=Branch1]" ], "smiles": [ "COCC=Cc1cnc(Nc2cnc(C#N)cn2)cc1NCC1CCN(C(=O)OC(C)(C)C)CC1", "COCC=Cc1cnc(Nc2cnc(C#N)cn2)cc1NCC1CCNCC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Branch1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring2][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][C][Ring1][O][=N][C][C][Ring2][Ring1][C][C][C][Ring2][Ring2][C]", "[O][=S][=Branch1][C][=O][Branch2][Ring2][N][N][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring2][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][C][Ring1][O][=N][C][C][Ring2][Ring1][C][N][C][C][N][C][C][Ring1][=Branch1]" ], "smiles": [ "CCOC(=O)N1CCN(S(=O)(=O)NCCOc2ccc3c(c2)C(C2(c4ccc(Cl)cc4)CCC2)=NCC3)CC1", "O=S(=O)(NCCOc1ccc2c(c1)C(C1(c3ccc(Cl)cc3)CCC1)=NCC2)N1CCNCC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][=C][N][N][=C][N][=C][Branch1][C][N][C][Ring1][#Branch1][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]", "[C][C][O][C][=Branch1][C][=O][C][=C][N][N][=C][N][=C][Branch1][C][N][C][Ring1][#Branch1][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1]" ], "smiles": [ "CCOC(=O)c1cn2ncnc(N)c2c1-c1ccc([N+](=O)[O-])cc1", "CCOC(=O)c1cn2ncnc(N)c2c1-c1ccc(N)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: C1CCOC1.CCO .", "role": "assistant" } ]

{ "selfies": [ "[N][C][C][C][C][C][C][C][=C][Ring1][Branch1][C][C][=C][C][Ring1][=Branch1]", "[O][=C][Branch1][=C][O][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F]", "[O][=C][Branch2][Ring1][C][N][C][C][C][C][C][C][C][=C][Ring1][Branch1][C][C][=C][C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F]" ], "smiles": [ "NCCCC1CCC2=C1CC=CC2", "O=C(OC(=O)C(F)(F)F)C(F)(F)F", "O=C(NCCCC1CCC2=C1CC=CC2)C(F)(F)F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CCOCC .", "role": "assistant" } ]

{ "selfies": [ "[C][C][N][C][C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][C][Ring1][N]", "[O][=C][N][C][C][C][C][C][Ring1][#Branch1][N][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][Cl]", "[C][C][N][C][C][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=N][C][=C][Branch1][C][Cl][C][Branch1][N][N][C][C][C][C][C][N][C][Ring1][#Branch1][=O][=N][Ring1][S][C][=C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][N]" ], "smiles": [ "CCN1CCc2ccc(N)cc2CC1", "O=C1NCCCCC1Nc1nc(Cl)ncc1Cl", "CCN1CCc2ccc(Nc3ncc(Cl)c(NC4CCCCNC4=O)n3)cc2CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CC(C)O.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][=C][Branch1][Ring2][C][C][N][C][=C][Ring1][=Branch2][O][C]", "[C][C][=C][C][=C][Branch1][Branch2][N][C][C][=Branch1][C][=O][O][C][=C][Ring1][O]", "[C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring2][O][C]" ], "smiles": [ "COc1ccc(CCN)cc1OC", "Cc1ccc(NCC(=O)O)cc1", "COc1ccc(CCNC(=O)CNc2ccc(C)cc2)cc1OC" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=C][C][=C][Branch1][=N][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][S][C][=C][Ring2][Ring1][=Branch1]", "[C][O][C][=C][C][=C][Branch1][=C][C][=C][C][=C][Branch1][Ring2][C][C][O][C][=C][Ring1][=Branch2][C][=C][Ring1][#C]" ], "smiles": [ "COc1ccc(-c2ccc(CCOCc3ccccc3)cc2)cc1", "COc1ccc(-c2ccc(CCO)cc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[F][C][=C][C][Branch2][Ring1][=Branch1][C][=N][C][Branch1][O][N][C][C][C][C][O][C][C][Ring1][=Branch1][=C][N][=C][Ring1][=C][Cl][=C][Branch1][C][Cl][C][=N][Ring2][Ring1][=Branch1]", "[N][C][C][C][C][Branch1][C][N][C][C][Ring1][#Branch1]", "[N][C][C][C][C][Branch2][Ring2][=Branch1][N][C][=C][C][Branch2][Ring1][=Branch1][C][=N][C][Branch1][O][N][C][C][C][C][O][C][C][Ring1][=Branch1][=C][N][=C][Ring1][=C][Cl][=C][Branch1][C][Cl][C][=N][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][=N]" ], "smiles": [ "Fc1cc(-c2nc(NCC3CCOCC3)cnc2Cl)c(Cl)cn1", "NC1CCC(N)CC1", "NC1CCC(Nc2cc(-c3nc(NCC4CCOCC4)cnc3Cl)c(Cl)cn2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CS(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][N][N][=C][C][C][=Branch1][C][=O][NH1][C][Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=N][C][=Ring1][S][Ring2][Ring1][Ring1]", "[O][=C][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][Br]", "[C][C][C][N][N][=C][C][C][=Branch1][C][=O][NH1][C][Branch1][#C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O][C][C][=N][C][=Ring1][P][Ring2][Ring1][Ring2]" ], "smiles": [ "CCCn1ncc2c(=O)[nH]c(-c3ccccc3OCC)nc21", "O=C1CCC(=O)N1Br", "CCCn1ncc2c(=O)[nH]c(-c3cc(Br)ccc3OCC)nc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][Branch1][C][O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]", "[O][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]" ], "smiles": [ "O=C(O)c1cccc(Cl)c1C(F)(F)F", "OCc1cccc(Cl)c1C(F)(F)F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][S][=Branch1][C][=O][=Branch1][C][=O][Cl]", "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N]", "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][S][Branch1][C][C][=Branch1][C][=O][=O]" ], "smiles": [ "CS(=O)(=O)Cl", "Cc1ccccc1N", "Cc1ccccc1NS(C)(=O)=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][N][C][=N][C][=C][S][Ring1][Branch1]", "[C][O][C][=C][C][=N][C][=C][C][Branch2][Ring1][#Branch1][O][C][=C][C][=C][Branch1][C][N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][=C][Ring2][Ring1][C][C][=C][Ring2][Ring1][=Branch1][O][C]", "[O][=C][Branch1][#Branch2][O][C][Branch1][C][Cl][Branch1][C][Cl][Cl][O][C][Branch1][C][Cl][Branch1][C][Cl][Cl]", "[C][O][C][=C][C][=N][C][=C][C][Branch2][Ring2][=Branch2][O][C][=C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=N][C][=C][S][Ring1][Branch1][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][N][C][=C][Ring2][Ring1][S][O][C]" ], "smiles": [ "CC(N)c1nccs1", "COc1cc2nccc(Oc3ccc(N)c(C(F)(F)F)c3)c2cc1OC", "O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl", "COc1cc2nccc(Oc3ccc(NC(=O)NC(C)c4nccs4)c(C(F)(F)F)c3)c2cc1OC" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "ClC(Cl)Cl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][N][C][O][C][Ring1][Branch1]", "[C][N][N][=C][Branch2][Ring1][Branch1][C][=C][N][=C][NH1][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Ring1][Branch2][=N][Ring1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring2][Ring1][=Branch1]", "[C][N][N][=C][Branch2][Ring1][=C][C][=C][N][=C][NH1][C][=C][Branch1][#C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][O][C][Ring1][Branch1][C][Ring1][=N][=N][Ring1][P][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring2][Ring1][O]" ], "smiles": [ "CC1(N)COC1", "Cn1nc(-c2cnc3[nH]cc(C(=O)O)c3n2)c2ccc(F)cc21", "Cn1nc(-c2cnc3[nH]cc(C(=O)NC4(C)COC4)c3n2)c2ccc(F)cc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][=C][N][=C][Branch2][Branch1][=Branch2][N][Branch2][Ring2][C][C][C][C][=C][S][C][Branch2][Ring1][=Branch1][S][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=N][Ring1][S][C][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][N][N][=C][Ring2][Ring2][=Branch1]", "[C][C][C][=C][N][=C][Branch2][Ring2][S][N][Branch2][Ring1][=Branch2][C][C][C][=C][S][C][Branch1][=C][S][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][=N][Ring1][N][C][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][N][N][=C][Ring2][Ring2][C]" ], "smiles": [ "CCc1cnc(N(CCc2csc(SC(C)(C)C(=O)OC(C)(C)C)n2)Cc2ccc(N3CCOCC3)cc2)nc1", "CCc1cnc(N(CCc2csc(SC(C)(C)C(=O)O)n2)Cc2ccc(N3CCOCC3)cc2)nc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][N]", "[O][C][C][C][=Branch2][Ring1][#Branch2][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][Branch1][O][C][C][Br][C][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[C][N][C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][#C][=C][Branch1][Ring2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1]" ], "smiles": [ "CN", "OCCC(=C(c1ccccc1)c1ccc(OCCBr)cc1)c1ccccc1", "CNCCOc1ccc(C(=C(CCO)c2ccccc2)c2ccccc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][Ring1][Ring1]", "[C][C][C][C][C][C][C][C][N][C][C]", "[C][C][C][C][C][C][C][C][N][Branch1][Ring1][C][C][C][C][O]" ], "smiles": [ "C1CO1", "CCCCCCCCNCC", "CCCCCCCCN(CC)CCO" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][C][N][Branch2][Ring1][Branch1][C][C][C][N][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][C][N][Branch1][P][C][C][C][N][C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]" ], "smiles": [ "CC(C)(C)OC(=O)NCCCCN(CCCNCc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C", "CC(C)(C)OC(=O)NCCCCN(CCCNCc1ccc(N)cc1)C(=O)OC(C)(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][Ring1][#C][N+1][=Branch1][C][=O][O-1]", "[C][C][=C][Branch1][C][N][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]" ], "smiles": [ "Cc1c(C(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-]", "Cc1c(N)cccc1C(=O)c1ccc(F)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CCO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][C][C][O][C][=C][C][=N][C][Branch1][S][C][S][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=C][Ring1][P][C]", "[O][=C][Branch1][Ring1][O][O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]", "[C][O][C][C][C][O][C][=C][C][=N][C][Branch2][Ring1][Ring1][C][S][=Branch1][C][=O][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=C][Ring2][Ring1][C][C]" ], "smiles": [ "COCCCOc1ccnc(CSc2nc3ccccc3[nH]2)c1C", "O=C(OO)c1cccc(Cl)c1", "COCCCOc1ccnc(CS(=O)c2nc3ccccc3[nH]2)c1C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CCOCC.ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][C][=C][Ring1][=Branch2][O][C][C][C][C][Br]", "[F][C][=C][C][=C][C][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][=N][NH1][C][Ring1][O][=C][Ring1][#C]", "[C][O][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][C][=C][Ring1][=Branch2][O][C][C][C][C][N][C][C][C][Branch1][P][C][=N][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][Ring1][S]" ], "smiles": [ "COc1cc(C(C)=O)ccc1OCCCCBr", "Fc1ccc2c(C3CCNCC3)n[nH]c2c1", "COc1cc(C(C)=O)ccc1OCCCCN1CCC(c2n[nH]c3cc(F)ccc23)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][N][C][Branch1][O][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][Ring2][Ring1][Ring2]", "[O][=C][Branch1][C][O][C][N][C][Branch1][O][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][Ring2][Ring1][Ring2]" ], "smiles": [ "CC(C)(C)OC(=O)Cn1c(SCc2ccccc2)nc2cc([N+](=O)[O-])ccc21", "O=C(O)Cn1c(SCc2ccccc2)nc2cc([N+](=O)[O-])ccc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "ClCCl.O=C(O)C(F)(F)F .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][Branch2][Ring1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][=C][=N][O][Ring2][Ring1][=Branch1]", "[C][C][=C][C][Branch2][Ring1][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][N][C][C][Ring1][Branch2][=N][O][Ring1][S]" ], "smiles": [ "Cc1cc(-c2ccc3c(c2)CCN(C(=O)C(F)(F)F)CC3)no1", "Cc1cc(-c2ccc3c(c2)CCNCC3)no1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][N][C][Branch1][C][C][=O]", "[C][C][C][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][N]" ], "smiles": [ "CCCOc1cc2ccccc2cc1NC(C)=O", "CCCOc1cc2ccccc2cc1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][S][Branch1][C][N][=Branch1][C][=O][=O]", "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring2][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][C][F][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][N][Ring1][S][=C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][N]", "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Branch1][Ring2][C][=C][C][=C][C][Branch2][Ring2][Branch2][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][C][F][=C][C][Branch1][=C][C][=Branch1][C][=O][N][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring1][=C][N][Ring2][Ring1][Ring2][=C][Ring2][Ring1][#Branch2][C][C][Ring2][Ring1][S]" ], "smiles": [ "CS(N)(=O)=O", "Cc1ccccc1N1CCN(c2cccc(C3CC(C)(C)c4cc(F)cc(C(=O)O)c4N3)c2)CC1", "Cc1ccccc1N1CCN(c2cccc(C3CC(C)(C)c4cc(F)cc(C(=O)NS(C)(=O)=O)c4N3)c2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][C][C][O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][F][=C][Ring1][Branch2][Ring1][O]", "[O][=C][Branch1][C][O][C][C][C][O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][F][=C][Ring1][Branch2][Ring1][O]" ], "smiles": [ "COC(=O)CC1COc2cc(O)cc(F)c21", "O=C(O)CC1COc2cc(O)cc(F)c21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][O][C][C][N][Ring1][=Branch1][C][=C][C][Branch1][S][C][Branch1][C][C][Branch1][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][=N][Ring2][Ring1][Ring2]", "[O][=C][Branch1][C][Cl][O][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[C][C][C][O][C][C][N][Ring1][=Branch1][C][=C][C][Branch1][S][C][Branch1][C][C][Branch1][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][=N][C][Branch2][Ring1][=Branch2][C][=C][C][=C][Branch1][#C][N][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][S][=N][Ring2][Ring1][=N]" ], "smiles": [ "CC1COCCN1c1cc(C(C)(C)S(C)(=O)=O)nc(-c2ccc(N)cc2)n1", "O=C(Cl)Oc1ccccc1", "CC1COCCN1c1cc(C(C)(C)S(C)(=O)=O)nc(-c2ccc(NC(=O)Oc3ccccc3)cc2)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be C1COCCO1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Branch1][C][Br][=C][Ring1][O]", "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][Br]" ], "smiles": [ "COC(=O)c1ccc(C(=O)OC)c(Br)c1", "COC(=O)c1ccc(C(=O)O)cc1Br" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][Branch1][C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][C][Br][C][Branch1][C][C][=C][Ring1][N]", "[N][C][Branch1][C][N][=S]", "[C][O][C][=C][C][Branch1][C][C][=C][Branch1][O][C][=C][S][C][Branch1][C][N][=N][Ring1][=Branch1][C][Branch1][C][C][=C][Ring1][=C]" ], "smiles": [ "COc1cc(C)c(C(=O)CBr)c(C)c1", "NC(N)=S", "COc1cc(C)c(-c2csc(N)n2)c(C)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][C][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][C][Ring1][=C]", "[O][=C][Branch1][C][O][C][C][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][C][Ring1][=C]" ], "smiles": [ "CCOC(=O)C1CCc2nc(C(F)(F)F)ccc2C1", "O=C(O)C1CCc2nc(C(F)(F)F)ccc2C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][Branch1][#C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Ring1][=C][N+1][=Branch1][C][=O][O-1]", "[C][O][C][=C][C][Branch1][#C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Ring1][=C][N]" ], "smiles": [ "COc1cc(CC(=O)OC(C)(C)C)ccc1[N+](=O)[O-]", "COc1cc(CC(=O)OC(C)(C)C)ccc1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CCOC(C)=O.CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Br]", "[N][#C][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][C][N][C][C][Ring1][=C]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][N][C][C][C][Branch1][Ring1][C][#N][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][C][Ring1][S]" ], "smiles": [ "CC(C)(C)OC(=O)NCCCBr", "N#CC1(c2ccc(Cl)cc2Cl)CCNCC1", "CC(C)(C)OC(=O)NCCCN1CCC(C#N)(c2ccc(Cl)cc2Cl)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][N][=C][=O]", "[N][C][C][C][N][Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][O][Ring1][Branch1][C][Ring1][=C]", "[C][N][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][O][Ring1][Branch1][C][Ring1][=C]" ], "smiles": [ "CN=C=O", "NC1CCN(c2cccc3c2CCO3)C1", "CNC(=O)NC1CCN(c2cccc3c2CCO3)C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][Cl]", "[O][=N+1][Branch1][C][O-1][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][N][C][Ring1][#Branch1]", "[C][C][=Branch1][C][=O][N][C][C][N][N][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][Branch2][C][Ring1][N]" ], "smiles": [ "CC(=O)Cl", "O=[N+]([O-])c1cc2n(n1)CCNC2", "CC(=O)N1CCn2nc([N+](=O)[O-])cc2C1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][Ring1][C][=O][C][=C][Ring1][Branch2]", "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][Ring1][C][O][C][=C][Ring1][Branch2]" ], "smiles": [ "COC(=O)c1ccccc1-c1ccc(C=O)cc1", "COC(=O)c1ccccc1-c1ccc(CO)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][=C][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][O]" ], "smiles": [ "O=c1ccn(CC(F)(F)F)cc1OCc1ccccc1", "O=c1ccn(CC(F)(F)F)cc1O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][N]", "[O][=C][Branch1][C][Cl][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "CCCN", "O=C(Cl)c1ccccc1", "CCCNC(=O)c1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][Branch2][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring2][=N][C][=C][C][=C][Branch2][Ring1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][Branch1][P][C][=C][C][=Branch1][C][=O][N][O][C][C][C][C][C][O][Ring1][=Branch1][=C][Ring1][P][C][=C][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][S][C][=C][Ring2][Ring2][#Branch2]", "[C][C][=C][C][=C][Branch2][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][Branch1][=Branch2][C][=C][C][=Branch1][C][=O][N][O][=C][Ring1][O][C][=C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring2][Ring2]" ], "smiles": [ "Cc1ccc(S(=O)(=O)Nc2ccc(-c3ccc(S(=O)(=O)n4ccc(C=CC(=O)NOC5CCCCO5)c4)cc3)cc2)cc1", "Cc1ccc(S(=O)(=O)Nc2ccc(-c3ccc(S(=O)(=O)n4ccc(C=CC(=O)NO)c4)cc3)cc2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][Ring1][#C]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][S][C][Branch1][C][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][Ring1][#C]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCC(C(=O)c2ccc(Br)cc2)CC1", "CC(C)(C)OC(=O)N1CCC(C(O)c2ccc(Br)cc2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[Br][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[O][C][C][C][C][C][C][Cl]", "[Cl][C][C][C][C][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "BrCc1ccccc1", "OCCCCCCCl", "ClCCCCCCOCc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][Branch1][C][C][Ring1][P][C][C][Ring2][Ring1][Ring1]", "[O][=C][Branch2][Ring1][#Branch1][N][C][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][Branch1][Branch1][C][C][Ring1][=Branch2][C][C][Ring1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "COC(=O)C12CCC(NC(=O)OCc3ccccc3)(CC1)CC2", "O=C(NC12CCC(C(=O)O)(CC1)CC2)OCc1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][N][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]", "[N][C][=C][N][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]" ], "smiles": [ "O=[N+]([O-])c1cnc(Cl)c(Cl)c1", "Nc1cnc(Cl)c(Cl)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][Cl]", "[C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][N]", "[C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C]" ], "smiles": [ "CC(C)(C)CC(=O)Cl", "Cc1cc(Br)ccc1N", "Cc1cc(Br)ccc1NC(=O)CC(C)(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CC#N .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][Cl]", "[O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][C][Ring1][#Branch2][=C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "[C][C][=Branch1][C][=O][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][C][Ring1][#Branch2][=C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "CC(=O)Cl", "OC(c1ccccc1)c1cnc2c(C(F)(F)F)cccc2c1-c1ccccc1", "CC(=O)OC(c1ccccc1)c1cnc2c(C(F)(F)F)cccc2c1-c1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring2][Ring1][C][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][=C][N][=C][S][C][Ring1][Branch1][=N][Ring2][Ring1][Ring2][C][Ring2][Ring1][=Branch2]", "[C][O][C][=C][C][=C][Branch2][Ring1][#C][N][C][=N][C][Branch1][#C][N][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Ring1][Branch2][=N][C][S][C][=N][C][Ring1][P][=Ring1][Branch1][C][=C][Ring2][Ring1][Branch2][O][C]" ], "smiles": [ "COC(=O)C1CCN(c2nc(Nc3ccc(OC)c(OC)c3)c3ncsc3n2)C1", "COc1ccc(Nc2nc(N3CCC(C(=O)O)C3)nc3scnc23)cc1OC" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CO.O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=Branch2][Ring1][Branch1][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][C][C][=C][Ring1][#Branch2][N+1][=Branch1][C][=O][O-1][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][P]", "[C][C][=C][Branch1][C][N][C][Branch1][C][C][=C][C][=Branch1][Branch1][=C][Ring1][Branch2][N][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=Branch2]" ], "smiles": [ "Cc1c2c(c([N+](=O)[O-])c(C)c1[N+](=O)[O-])C(C)(C)CC2", "Cc1c(N)c(C)c2c(c1N)C(C)(C)CC2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][O][C][Branch1][C][C][=O]", "[C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][C][N][C][Branch1][C][O][C][C][O][C][Branch1][O][O][C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "[C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][Branch1][C][O][C][C][O][C][Branch1][O][O][C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]" ], "smiles": [ "CC(=O)OC(C)=O", "CCc1ccccc1CC(N)C(O)C1COC(OCC(C)(C)C)C(C)N1C(=O)OC(C)(C)C", "CCc1ccccc1CC(NC(C)=O)C(O)C1COC(OCC(C)(C)C)C(C)N1C(=O)OC(C)(C)C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][S][C][=N][C][Branch1][C][Cl][=C][Branch1][Ring1][C][#N][C][Branch1][Branch1][N][C][C][O][=N][Ring1][=N]", "[C][=C][C][=C][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][C][=C][Ring1][N]", "[C][S][C][=N][C][Branch1][Branch1][N][C][C][O][=C][Branch1][Ring1][C][#N][C][Branch2][Ring1][Ring1][N][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][=N][Ring2][Ring1][Branch2]" ], "smiles": [ "CSc1nc(Cl)c(C#N)c(NCCO)n1", "c1ccc(C2CCNCC2)cc1", "CSc1nc(NCCO)c(C#N)c(N2CCC(c3ccccc3)CC2)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> Please propose potential solvents that might have been utilized in the provided chemical reaction.", "role": "user" }, { "content": "Sure. A potential answer could be: ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Branch2][Branch1][O][O][C][=C][C][=C][C][=C][Branch2][Ring1][#C][C][Branch1][C][C][Branch1][O][C][O][P][=Branch1][C][=O][Branch1][C][O][O][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring2][Ring2][Branch1]", "[C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Branch2][Ring2][=N][O][C][=C][C][=C][C][=C][Branch2][Ring1][C][C][Branch1][C][C][Branch1][C][N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][C][Ring1][#C][=C][Ring2][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring2][Ring1][=C]" ], "smiles": [ "CCC(C)(C)C1CCC(Oc2ccc3cc(C(C)(COP(=O)(O)O)NC(=O)OC(C)(C)C)ccc3c2C(F)(F)F)CC1", "CCC(C)(C)C1CCC(Oc2ccc3cc(C(C)(N)COP(=O)(O)O)ccc3c2C(F)(F)F)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be Cl .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][Branch1][C][O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][C][C][O]", "[O][C][C][C][=C][Branch1][Ring1][C][O][C][=C][C][Branch1][C][F][=C][Ring1][=Branch2][F]" ], "smiles": [ "O=C(O)c1ccc(F)c(F)c1CCO", "OCCc1c(CO)ccc(F)c1F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][N][Ring2][Ring1][Branch2][C][C][C][C][C][C][Ring1][=Branch1]", "[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][Branch1][C][N][C][N][Ring1][P][C][C][C][C][C][C][Ring1][=Branch1]" ], "smiles": [ "Cc1ccc2c(c1)N(CC(=O)C(C)(C)C)C(=O)C(NC(=O)OC(C)(C)C)CN2C1CCCCC1", "Cc1ccc2c(c1)N(CC(=O)C(C)(C)C)C(=O)C(N)CN2C1CCCCC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][C][O][C][=C][C][=C][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][C][=C][Ring1][N][C][C][Ring2][Ring1][Branch1]", "[F][C][Branch1][C][F][Branch1][C][F][C][=N][N][=C][C][=C][C][Branch1][C][Cl][=N][N][Ring1][#Branch2][Ring1][#Branch1]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Branch1][Ring1][C][C][O][C][=C][C][=C][Branch2][Ring2][Ring2][C][C][C][N][Branch2][Ring1][Branch2][C][C][=C][C][=N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][Ring1][=Branch2][N][=Ring1][=N][C][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch2][C][C][Ring2][Ring2][C]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCN(CCOc2ccc(C3CCNCC3)cc2)CC1", "FC(F)(F)c1nnc2ccc(Cl)nn12", "CC(C)(C)OC(=O)N1CCN(CCOc2ccc(C3CCN(c4ccc5nnc(C(F)(F)F)n5n4)CC3)cc2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][=C][Branch2][Ring1][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][P]", "[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N]" ], "smiles": [ "COc1ccc(CC(C(=O)O)c2ccccc2)cc1", "COc1ccc2c(c1)C(=O)C(c1ccccc1)C2" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][Branch2][Ring1][#Branch1][C][C][N][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][Ring2]", "[O][=C][Branch1][C][O][C][=C][Branch1][C][F][C][Branch1][C][F][=C][C][C][=C][NH1][C][Ring1][O][=Ring1][Branch1]", "[C][C][=C][C][=C][Branch2][Ring2][P][C][C][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][Branch1][C][F][=C][C][C][=C][NH1][C][Ring1][O][=Ring1][Branch1][C][=C][Ring2][Ring1][P]" ], "smiles": [ "Cc1ccc(CCNCc2ccc(C(C)(C)C)cc2)cc1", "O=C(O)c1c(F)c(F)cc2cc[nH]c12", "Cc1ccc(CCN(Cc2ccc(C(C)(C)C)cc2)C(=O)c2c(F)c(F)cc3cc[nH]c23)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>.<molecule_2d>>><molecule_2d> From the provided chemical reaction, propose some possible solvents that could have been used.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][Cl][C][=C][Ring1][#Branch2]", "[O][=S][=Branch1][C][=O][C][C][C][Branch1][C][O][C][C][Ring1][Branch2]", "[C][C][=C][C][=C][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2][C][=C][Ring2][Ring1][C]" ], "smiles": [ "Cc1ccc(S(=O)(=O)Cl)cc1", "O=S1(=O)CCC(O)CC1", "Cc1ccc(S(=O)(=O)OC2CCS(=O)(=O)CC2)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be c1ccncc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][C][C][N][=C][=O]", "[C][C][C][C][C][=N][C][=C][Branch1][C][N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][O][N][Ring1][=C][C][C][C][N]", "[C][C][C][C][N][C][=Branch1][C][=O][N][C][C][C][N][C][Branch1][Branch1][C][C][C][C][=N][C][=C][Branch1][C][N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][O][Ring2][Ring1][C]" ], "smiles": [ "CCCCN=C=O", "CCCCc1nc2c(N)nc3ccccc3c2n1CCCN", "CCCCNC(=O)NCCCn1c(CCCC)nc2c(N)nc3ccccc3c21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CN1CCCC1=O.O .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C]", "[N][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C][C][=C][Ring2][Ring1][#Branch1]" ], "smiles": [ "O=C(c1ccc([N+](=O)[O-])cc1)N1CCc2ccccc2-c2ccccc21", "Nc1ccc(C(=O)N2CCc3ccccc3-c3ccccc32)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CCO.CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][N][Branch2][Ring1][C][C][=N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][S][Ring1][=Branch2][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][S]", "[C][N][Branch2][Ring1][C][C][=N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][S][Ring1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1]" ], "smiles": [ "CN(c1nnc(C(F)(F)F)s1)C1CCN(C(=O)OCc2ccccc2)CC1", "CN(c1nnc(C(F)(F)F)s1)C1CCNCC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "[N][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]" ], "smiles": [ "CC(C)(C)OC(=O)OC(=O)OC(C)(C)C", "NCCc1ccc(O)cc1", "CC(C)(C)OC(=O)NCCc1ccc(O)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "C1CCOC1.O .", "role": "assistant" } ]

{ "selfies": [ "[C][=C][C][Br]", "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]", "[C][=C][C][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]" ], "smiles": [ "C=CCBr", "O=[N+]([O-])c1ccc(O)cc1", "C=CCOc1ccc([N+](=O)[O-])cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be Cc1ccccc1 .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Branch2][Ring1][=Branch2][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][N+1][=Branch1][C][=O][O-1][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]", "[C][O][C][=Branch1][C][=O][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Branch2][Ring1][Branch1][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]" ], "smiles": [ "COC(=O)C(C(=O)OC)C(Cc1cc(C(F)(F)F)ccc1[N+](=O)[O-])c1ccc(OC)cc1", "COC(=O)C(C(=O)OC)C(Cc1cc(C(F)(F)F)ccc1N)c1ccc(OC)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CO .", "role": "assistant" } ]

{ "selfies": [ "[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1]", "[N][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1]" ], "smiles": [ "O=[N+]([O-])c1c2ccccc2cc2ccccc12", "Nc1c2ccccc2cc2ccccc12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "What solvents could have been utilized in the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CC(=O)O.Cl .", "role": "assistant" } ]

{ "selfies": [ "[N][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][#Branch2]", "[O][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]", "[N][C][=C][C][=C][Branch2][Ring1][=Branch2][O][C][=C][C][=C][C][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=N][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring2][Ring1][#Branch1]" ], "smiles": [ "Nc1ccc(F)c([N+](=O)[O-])c1", "O=C(Nc1cccc(O)c1)C(F)(F)F", "Nc1ccc(Oc2cccc(NC(=O)C(F)(F)F)c2)c([N+](=O)[O-])c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=C][C][Branch2][Ring1][#Branch1][C][C][=N][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][N][=C][Branch1][C][F][C][=C][Ring2][Ring1][Ring1][O]", "[O][=S][=Branch1][C][=O][Branch2][Ring1][O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F]", "[C][O][C][=C][C][Branch2][Ring1][#Branch1][C][C][=N][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][N][=C][Branch1][C][F][C][=C][Ring2][Ring1][Ring1][O][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F]" ], "smiles": [ "COc1cc(-c2cnn(C(=O)OC(C)(C)C)c2)c(F)cc1O", "O=S(=O)(N(c1ccccc1)S(=O)(=O)C(F)(F)F)C(F)(F)F", "COc1cc(-c2cnn(C(=O)OC(C)(C)C)c2)c(F)cc1OS(=O)(=O)C(F)(F)F" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][N][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][N][C][C][Ring1][=Branch1]", "[C][C][=C][C][Branch1][C][Cl][=N][C][Branch1][C][C][=N][Ring1][Branch2]", "[C][C][=C][C][Branch2][Ring1][#C][N][C][C][C][Branch2][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][C][=N][C][Branch1][C][C][=N][Ring2][Ring1][=Branch2]" ], "smiles": [ "CN(C(=O)OCc1ccccc1)C1CCNCC1", "Cc1cc(Cl)nc(C)n1", "Cc1cc(N2CCC(N(C)C(=O)OCc3ccccc3)CC2)nc(C)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][C][C][Ring1][=Branch1]", "[Cl][C][=N][C][=C][Branch1][C][Br][C][=N][Ring1][#Branch1]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][Br][C][=N][Ring1][#Branch1][C][C][Ring1][=N]" ], "smiles": [ "CC(C)(C)OC(=O)N1CCNCC1", "Clc1ncc(Br)cn1", "CC(C)(C)OC(=O)N1CCN(c2ncc(Br)cn2)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CC#N .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Ring1][C][N][C][=C][Ring1][Branch2]", "[N][C][C][=C][C][=C][Branch1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][S]" ], "smiles": [ "COC(=O)c1ccccc1Cc1ccc(CN)cc1", "NCc1ccc(Cc2ccccc2C(=O)O)cc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=N][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][Ring1][#Branch2][=C][Ring1][=C]", "[O][=C][Branch1][C][O][C][=C][C][=C][C][=N][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][Ring1][#Branch2][=C][Ring1][=C]" ], "smiles": [ "COC(=O)c1ccc2cnn(C3CCCC3)c2c1", "O=C(O)c1ccc2cnn(C3CCCC3)c2c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][C][=C][S][C][=C][N][=C][N][Ring1][Branch2][Ring1][Branch1]", "[O][C][C][C][=C][S][C][=C][N][=C][N][Ring1][Branch2][Ring1][Branch1]" ], "smiles": [ "CCOC(=O)Cc1csc2cncn12", "OCCc1csc2cncn12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following chemical reaction <molecule_2d>>><molecule_2d>, what are some potential solvents that could have been employed?", "role": "user" }, { "content": "CO .", "role": "assistant" } ]

{ "selfies": [ "[Br][Br]", "[C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2]", "[Br][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring2][Ring1][Ring2][Ring1][=Branch1]" ], "smiles": [ "BrBr", "c1ccc(-c2c3ccccc3cc3ccccc23)cc1", "Brc1c2ccccc2c(-c2ccccc2)c2ccccc12" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "ClC(Cl)(Cl)Cl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "[N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][=Branch2][C][=C][C][=C][O][Ring1][Branch1]", "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][=Branch2][C][=C][C][=C][O][Ring1][Branch1]" ], "smiles": [ "CC(C)(C)OC(=O)OC(=O)OC(C)(C)C", "NCc1ccccc1-n1nc(C(F)(F)F)cc1-c1ccco1", "CC(C)(C)OC(=O)NCc1ccccc1-n1nc(C(F)(F)F)cc1-c1ccco1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "C1CCOC1.CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][C][Branch1][C][C][=N][Ring1][Branch2]", "[O][C][C][Branch1][C][F][Branch1][C][F][F]", "[C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][=N][Ring1][=N]" ], "smiles": [ "COC(=O)c1cnc(Cl)c(C)n1", "OCC(F)(F)F", "COC(=O)c1cnc(OCC(F)(F)F)c(C)n1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given this chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some solvents that could have been used?", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch2][=Branch1][Ring2][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch2][Ring2][#Branch1][N][C][C][Branch2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O]", "[C][N][C][Branch2][Ring2][=Branch2][C][N][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][O][C][=C][Branch1][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]" ], "smiles": [ "CC(=CC(C(C)C)N(C)C(=O)C(NCC(N(C)C(=O)OC(C)(C)C)C(C)(C)c1ccccc1)C(C)(C)C)C(=O)O", "CNC(CNC(C(=O)N(C)C(C=C(C)C(=O)O)C(C)C)C(C)(C)C)C(C)(C)c1ccccc1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][Branch1][C][C][Si][Branch1][C][C][Branch1][C][C][Cl]", "[O][C][=C][C][=C][NH1][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2]", "[C][C][Branch1][C][C][Branch1][C][C][Si][Branch1][C][C][Branch1][C][C][O][C][=C][C][=C][NH1][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2]" ], "smiles": [ "CC(C)(C)[Si](C)(C)Cl", "Oc1ccc2[nH]ncc2c1", "CC(C)(C)[Si](C)(C)Oc1ccc2[nH]ncc2c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "CN(C)C=O .", "role": "assistant" } ]

{ "selfies": [ "[C][O][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][C][=Ring1][=N][N][Branch1][C][C][C][Ring2][Ring1][Ring1][=O]", "[C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][C][=C][Ring1][N][C][=Branch1][C][=O][N][Branch1][Branch1][C][C][C][O][C][=Branch1][C][=O][N][Ring1][N][C]" ], "smiles": [ "COC(=O)CCn1c(=O)c2c(C)c(-c3ccc(Cl)cc3)sc2n(C)c1=O", "Cc1c(-c2ccc(Cl)cc2)sc2c1c(=O)n(CCCO)c(=O)n2C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please suggest some possible solvents that could have been used in the following chemical reaction <molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "CCO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][Cl][=C][Ring1][#Branch2]", "[O][=C][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][Br]", "[O][=S][=Branch1][C][=O][Branch1][C][Cl][C][=C][C][=C][C][Branch1][Ring1][C][Br][=C][Ring1][Branch2]" ], "smiles": [ "Cc1cccc(S(=O)(=O)Cl)c1", "O=C1CCC(=O)N1Br", "O=S(=O)(Cl)c1cccc(CBr)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CC#N .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=C][C][=C][Branch1][N][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]", "[C][C][=C][C][=C][Branch1][N][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][=C][Ring1][=N][N]" ], "smiles": [ "Cc1ccc(NC(=O)CN(C)C)cc1[N+](=O)[O-]", "Cc1ccc(NC(=O)CN(C)C)cc1N" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "CCOC(C)=O .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][O][C][Branch1][C][C][=O]", "[C][C][C][C][=C][Branch2][Ring1][#Branch2][O][C][C][C][S][C][=N][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][NH1][Ring1][N][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][Ring2][Ring1][#Branch2][O]", "[C][C][C][C][=C][Branch2][Ring1][#Branch2][O][C][C][C][S][C][=N][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][NH1][Ring1][N][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][Ring2][Ring1][#Branch2][O][C][Branch1][C][C][=O]" ], "smiles": [ "CC(=O)OC(C)=O", "CCCc1c(OCCCSc2nc3ccc(C(=O)O)cc3[nH]2)ccc(C(C)=O)c1O", "CCCc1c(OCCCSc2nc3ccc(C(=O)O)cc3[nH]2)ccc(C(C)=O)c1OC(C)=O" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Please provide possible solvents based on the following chemical reaction <molecule_2d>.<molecule_2d>>><molecule_2d>.", "role": "user" }, { "content": "ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][=Branch1][C][=O][O][C][Branch1][C][C][=O]", "[C][C][=C][Branch1][C][N][C][=C][C][=C][Ring1][#Branch1][F]", "[C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C]" ], "smiles": [ "CC(=O)OC(C)=O", "Cc1c(N)cccc1F", "CC(=O)Nc1cccc(F)c1C" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Given the following reaction <molecule_2d>.<molecule_2d>>><molecule_2d>, what are some possible solvents that could have been utilized?", "role": "user" }, { "content": "Cc1ccccc1 .", "role": "assistant" } ]

{ "selfies": [ "[O][=C][C][C][C][=C][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][Ring1][=N][Ring1][S]", "[O][C][C][C][C][=C][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][Ring1][=N][Ring1][S]" ], "smiles": [ "O=C1CCc2ccc(-c3cccc(F)c3)cc21", "OC1CCc2ccc(-c3cccc(F)c3)cc21" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you suggest some solvents that might have been used in the given chemical reaction? <molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "A probable solvent could be CO .", "role": "assistant" } ]

{ "selfies": [ "[C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1]", "[C][C][=C][Branch1][C][Cl][N][=C][N][=C][Ring1][#Branch1][Cl]", "[C][C][=C][Branch1][C][Cl][N][=C][N][=C][Ring1][#Branch1][O][C][C][C][N][Branch1][O][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C][C][Ring1][N]" ], "smiles": [ "CC(C)OC(=O)N1CCC(O)CC1", "Cc1c(Cl)ncnc1Cl", "Cc1c(Cl)ncnc1OC1CCN(C(=O)OC(C)C)CC1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Can you provide potential solvents for the following chemical reaction? <molecule_2d>.<molecule_2d>>><molecule_2d>", "role": "user" }, { "content": "C1CCOC1 .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][Branch2][O][Ring1][O]", "[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][O][Ring1][#Branch2]" ], "smiles": [ "CCOC(=O)c1cc2cc(OC)ccc2o1", "CCOC(=O)c1cc2cc(O)ccc2o1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "<molecule_2d>>><molecule_2d> Based on the given chemical reaction, can you propose some likely solvents that might have been utilized?", "role": "user" }, { "content": "A possible solvent can be ClCCl .", "role": "assistant" } ]

{ "selfies": [ "[C][C][O][C][=Branch1][C][=O][C][C][=N][N][Branch2][Ring1][N][C][=N][C][=C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][C][Cl][C][=C][Ring1][=C][NH1][Ring1][P][C][=Ring2][Ring1][=Branch1]", "[O][=C][Branch1][C][O][C][C][=N][N][Branch2][Ring1][N][C][=N][C][=C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][C][Cl][C][=C][Ring1][=C][NH1][Ring1][P][C][=Ring2][Ring1][=Branch1]" ], "smiles": [ "CCOC(=O)c1cnn(-c2nc3cc(Oc4ccccc4)c(Cl)cc3[nH]2)c1", "O=C(O)c1cnn(-c2nc3cc(Oc4ccccc4)c(Cl)cc3[nH]2)c1" ] }

[ { "content": "You are a chemist. Now you are given a reaction equation. Please predict the possible solvents of the reaction. The reaction equation has the following format:\n```\nreactant1.reactant2. ... .reactantN>>product\n```\nYour task is to predict the structure representation of the solvents. We provide the SMILES of the reactions.", "role": "system" }, { "content": "Based on the given chemical reaction <molecule_2d>>><molecule_2d>, suggest some possible solvents.", "role": "user" }, { "content": "The solvent can be CC(=O)O .", "role": "assistant" } ]