Product OPENEYE NAME: 3-[4-(1H-indol-3-yl)-1-piperidyl]-N-(4-methoxy-2-nitro-phenyl)propanamide
CAS Name: 3-[4-(1H-indol-3-yl)-1-piperidinyl]-N-(4-methoxy-2-nitrophenyl)propanamide
IUPAC NAME: 3-[4-(1H-indol-3-yl)piperidin-1-yl]-N-(4-methoxy-2-nitrophenyl)propanamide
SYSTEMATIC NAME: 3-[4-(1H-indol-3-yl)piperidin-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide
MOLECULAR FORMULA: C23H26N4O4
MOLECULAR WEIGHT: 422.47694
SMILES: COC1=CC(=C(C=C1)NC(=O)CCN2CCC(CC2)C3=CNC4=CC=CC=C43)[N+](=O)[O-]
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Product OPENEYE NAME: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide
CAS Name: 3-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-N-(4-nitrophenyl)propanamide
IUPAC NAME: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide
SYSTEMATIC NAME: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide
MOLECULAR FORMULA: C22H25N4O3+
MOLECULAR WEIGHT: 393.4589
SMILES: C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 3-[4-(1H-indol-3-yl)-1-piperidyl]-N-(4-nitrophenyl)propanamide
CAS Name: 3-[4-(1H-indol-3-yl)-1-piperidinyl]-N-(4-nitrophenyl)propanamide
IUPAC NAME: 3-[4-(1H-indol-3-yl)piperidin-1-yl]-N-(4-nitrophenyl)propanamide
SYSTEMATIC NAME: 3-[4-(1H-indol-3-yl)piperidin-1-yl]-N-(4-nitrophenyl)propanamide
MOLECULAR FORMULA: C22H24N4O3
MOLECULAR WEIGHT: 392.45096
SMILES: C1CN(CCC1C2=CNC3=CC=CC=C32)CCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: (3-methoxycarbonyl-2-furyl)methyl 1-(2-fluorophenyl)-5-methyl-pyrazole-4-carboxylate
CAS Name: 1-(2-fluorophenyl)-5-methyl-4-pyrazolecarboxylic acid (3-methoxycarbonyl-2-furanyl)methyl ester
IUPAC NAME: (3-methoxycarbonylfuran-2-yl)methyl 1-(2-fluorophenyl)-5-methylpyrazole-4-carboxylate
SYSTEMATIC NAME: (3-methoxycarbonylfuran-2-yl)methyl 1-(2-fluorophenyl)-5-methyl-pyrazole-4-carboxylate
MOLECULAR FORMULA: C18H15FN2O5
MOLECULAR WEIGHT: 358.320503
SMILES: CC1=C(C=NN1C2=CC=CC=C2F)C(=O)OCC3=C(C=CO3)C(=O)OC
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Product OPENEYE NAME: N-(4-nitrophenyl)-3-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]propanamide
CAS Name: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazin-4-iumyl]-N-(4-nitrophenyl)propanamide
IUPAC NAME: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]-N-(4-nitrophenyl)propanamide
SYSTEMATIC NAME: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]-N-(4-nitrophenyl)propanamide
MOLECULAR FORMULA: C23H27N6O4+
MOLECULAR WEIGHT: 451.49828
SMILES: CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCN(CC3)CCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: N-(4-nitrophenyl)-3-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanamide
CAS Name: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]-N-(4-nitrophenyl)propanamide
IUPAC NAME: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide
SYSTEMATIC NAME: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide
MOLECULAR FORMULA: C23H26N6O4
MOLECULAR WEIGHT: 450.49034
SMILES: CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)CCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: N-(2-methyl-4-nitro-phenyl)-3-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]propanamide
CAS Name: N-(2-methyl-4-nitrophenyl)-3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazin-4-iumyl]propanamide
IUPAC NAME: N-(2-methyl-4-nitrophenyl)-3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]propanamide
SYSTEMATIC NAME: N-(2-methyl-4-nitro-phenyl)-3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]propanamide
MOLECULAR FORMULA: C24H29N6O4+
MOLECULAR WEIGHT: 465.52486
SMILES: CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCN(CC3)CCC(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])C
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Product OPENEYE NAME: N-(2-methyl-4-nitro-phenyl)-3-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanamide
CAS Name: N-(2-methyl-4-nitrophenyl)-3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]propanamide
IUPAC NAME: N-(2-methyl-4-nitrophenyl)-3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanamide
SYSTEMATIC NAME: N-(2-methyl-4-nitro-phenyl)-3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanamide
MOLECULAR FORMULA: C24H28N6O4
MOLECULAR WEIGHT: 464.51692
SMILES: CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)CCC(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])C
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Product OPENEYE NAME: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide
CAS Name: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)-1-piperidin-1-iumyl]propanamide
IUPAC NAME: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide
SYSTEMATIC NAME: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide
MOLECULAR FORMULA: C21H24N3O2+
MOLECULAR WEIGHT: 350.43416
SMILES: C1C[NH+](CCC1C2=CC=C(C=C2)O)CCC(=O)NC3=CC=CC(=C3)C#N
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Product OPENEYE NAME: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)-1-piperidyl]propanamide
CAS Name: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)-1-piperidinyl]propanamide
IUPAC NAME: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide
SYSTEMATIC NAME: N-(3-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide
MOLECULAR FORMULA: C21H23N3O2
MOLECULAR WEIGHT: 349.42622
SMILES: C1CN(CCC1C2=CC=C(C=C2)O)CCC(=O)NC3=CC=CC(=C3)C#N
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Product OPENEYE NAME: ethyl (3R)-1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
CAS Name: (3R)-1-[(2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-1-(2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonylpiperidine-3-carboxylate
MOLECULAR FORMULA: C19H25N3O3S
MOLECULAR WEIGHT: 375.4851
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)N3CCC[C@H](C3)C(=O)OCC)C)C
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Product OPENEYE NAME: ethyl (3S)-1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
CAS Name: (3S)-1-[(2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-1-(2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-1-(2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl)carbonylpiperidine-3-carboxylate
MOLECULAR FORMULA: C19H25N3O3S
MOLECULAR WEIGHT: 375.4851
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)N3CCC[C@@H](C3)C(=O)OCC)C)C
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Product OPENEYE NAME: ethyl (3R)-1-[(3S)-1-(3-fluoro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylate
CAS Name: (3R)-1-[[(3S)-1-(3-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-1-[(3S)-1-(3-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-1-[(3S)-1-(3-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperidine-3-carboxylate
MOLECULAR FORMULA: C20H25FN2O4
MOLECULAR WEIGHT: 376.421903
SMILES: CCOC(=O)[C@@H]1CCCN(C1)C(=O)[C@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)F
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Product OPENEYE NAME: ethyl (3S)-1-[(3S)-1-(3-fluoro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylate
CAS Name: (3S)-1-[[(3S)-1-(3-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-1-[(3S)-1-(3-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-1-[(3S)-1-(3-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperidine-3-carboxylate
MOLECULAR FORMULA: C20H25FN2O4
MOLECULAR WEIGHT: 376.421903
SMILES: CCOC(=O)[C@H]1CCCN(C1)C(=O)[C@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)F
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Product OPENEYE NAME: ethyl (3R)-1-[(3R)-1-(3-fluoro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylate
CAS Name: (3R)-1-[[(3R)-1-(3-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-1-[(3R)-1-(3-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-1-[(3R)-1-(3-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperidine-3-carboxylate
MOLECULAR FORMULA: C20H25FN2O4
MOLECULAR WEIGHT: 376.421903
SMILES: CCOC(=O)[C@@H]1CCCN(C1)C(=O)[C@@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)F
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Product OPENEYE NAME: ethyl (3S)-1-[(3R)-1-(3-fluoro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]piperidine-3-carboxylate
CAS Name: (3S)-1-[[(3R)-1-(3-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-1-[(3R)-1-(3-fluoro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-1-[(3R)-1-(3-fluoranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperidine-3-carboxylate
MOLECULAR FORMULA: C20H25FN2O4
MOLECULAR WEIGHT: 376.421903
SMILES: CCOC(=O)[C@H]1CCCN(C1)C(=O)[C@@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)F
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Product OPENEYE NAME: N-(2-nitrophenyl)-3-[[4-phenyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
CAS Name: N-(2-nitrophenyl)-3-[[4-phenyl-5-(1-pyrrolidin-1-iumylmethyl)-1,2,4-triazol-3-yl]thio]propanamide
IUPAC NAME: N-(2-nitrophenyl)-3-[[4-phenyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
SYSTEMATIC NAME: N-(2-nitrophenyl)-3-[[4-phenyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C22H25N6O3S+
MOLECULAR WEIGHT: 453.5373
SMILES: C1CC[NH+](C1)CC2=NN=C(N2C3=CC=CC=C3)SCCC(=O)NC4=CC=CC=C4[N+](=O)[O-]
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Product OPENEYE NAME: N-(2-nitrophenyl)-3-[[4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
CAS Name: N-(2-nitrophenyl)-3-[[4-phenyl-5-(1-pyrrolidinylmethyl)-1,2,4-triazol-3-yl]thio]propanamide
IUPAC NAME: N-(2-nitrophenyl)-3-[[4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
SYSTEMATIC NAME: N-(2-nitrophenyl)-3-[[4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C22H24N6O3S
MOLECULAR WEIGHT: 452.52936
SMILES: C1CCN(C1)CC2=NN=C(N2C3=CC=CC=C3)SCCC(=O)NC4=CC=CC=C4[N+](=O)[O-]
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Product OPENEYE NAME: methyl 5-[(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-2-fluoro-benzoate
CAS Name: 5-[[(6-cyclopropyl-1,3-dimethyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-2-fluorobenzoic acid methyl ester
IUPAC NAME: methyl 5-[(6-cyclopropyl-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-2-fluorobenzoate
SYSTEMATIC NAME: methyl 5-[(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-2-fluoranyl-benzoate
MOLECULAR FORMULA: C20H19FN4O3
MOLECULAR WEIGHT: 382.388263
SMILES: CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=CC(=C(C=C4)F)C(=O)OC)C
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Product OPENEYE NAME: N-[(3R)-1,1-dioxothiolan-3-yl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide
CAS Name: N-[(3R)-1,1-dioxo-3-thiolanyl]-2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide
IUPAC NAME: N-[(3R)-1,1-dioxothiolan-3-yl]-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide
SYSTEMATIC NAME: N-[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C15H19N3O3S2
MOLECULAR WEIGHT: 353.45966
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)N[C@@H]3CCS(=O)(=O)C3)C)C
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Product OPENEYE NAME: N-[(3S)-1,1-dioxothiolan-3-yl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide
CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide
IUPAC NAME: N-[(3S)-1,1-dioxothiolan-3-yl]-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide
SYSTEMATIC NAME: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C15H19N3O3S2
MOLECULAR WEIGHT: 353.45966
SMILES: CCC1=NC(=C2C(=C(SC2=N1)C(=O)N[C@H]3CCS(=O)(=O)C3)C)C
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