Product OPENEYE NAME: methyl 1-[2-[[(1S)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-oxo-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-oxo-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-oxidanylidene-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C19H29N2O3+
MOLECULAR WEIGHT: 333.44516
SMILES: C[C@@H](CCC1=CC=CC=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[[(1S)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-oxo-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-oxo-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-oxidanylidene-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C19H28N2O3
MOLECULAR WEIGHT: 332.43722
SMILES: C[C@@H](CCC1=CC=CC=C1)NC(=O)CN2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] (2S)-2-(4-chlorophenoxy)propanoate
CAS Name: (2S)-2-(4-chlorophenoxy)propanoic acid [(2S)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] (2S)-2-(4-chlorophenoxy)propanoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] (2S)-2-(4-chloranylphenoxy)propanoate
MOLECULAR FORMULA: C18H22ClN3O4
MOLECULAR WEIGHT: 379.83798
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC(=O)[C@H](C)OC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: methyl 1-[2-[[(1R)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C19H29N2O3+
MOLECULAR WEIGHT: 333.44516
SMILES: C[C@H](CCC1=CC=CC=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[[(1R)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C19H28N2O3
MOLECULAR WEIGHT: 332.43722
SMILES: C[C@H](CCC1=CC=CC=C1)NC(=O)CN2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: 2-[[(4-isopropoxybenzoyl)amino]carbamothioylamino]ethyl-dimethyl-ammonium
CAS Name: dimethyl-[2-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]amino]ethyl]ammonium
IUPAC NAME: dimethyl-[2-[[(4-propan-2-yloxybenzoyl)amino]carbamothioylamino]ethyl]azanium
SYSTEMATIC NAME: dimethyl-[2-[[(4-propan-2-yloxyphenyl)carbonylamino]carbamothioylamino]ethyl]azanium
MOLECULAR FORMULA: C15H25N4O2S+
MOLECULAR WEIGHT: 325.4496
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)NNC(=S)NCC[NH+](C)C
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Product OPENEYE NAME: 1-[2-(dimethylamino)ethyl]-3-[(4-isopropoxybenzoyl)amino]thiourea
CAS Name: 1-[2-(dimethylamino)ethyl]-3-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]thiourea
IUPAC NAME: 1-[2-(dimethylamino)ethyl]-3-[(4-propan-2-yloxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-[2-(dimethylamino)ethyl]-3-[(4-propan-2-yloxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C15H24N4O2S
MOLECULAR WEIGHT: 324.44166
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)NNC(=S)NCCN(C)C
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] (2R)-2-(4-chlorophenoxy)propanoate
CAS Name: (2R)-2-(4-chlorophenoxy)propanoic acid [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] (2R)-2-(4-chlorophenoxy)propanoate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] (2R)-2-(4-chloranylphenoxy)propanoate
MOLECULAR FORMULA: C20H22ClNO5
MOLECULAR WEIGHT: 391.84538
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC(=O)[C@@H](C)OC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: [2-(2-bromoanilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(2-bromoanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2-bromoanilino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H14BrNO4
MOLECULAR WEIGHT: 388.21206
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC=CC=C3Br
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Product OPENEYE NAME: 1-[(4-isopropoxybenzoyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]thiourea
IUPAC NAME: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(4-propan-2-yloxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(4-propan-2-yloxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C18H29N4O3S+
MOLECULAR WEIGHT: 381.51286
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)NNC(=S)NCCC[NH+]2CCOCC2
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Product OPENEYE NAME: 1-[(4-isopropoxybenzoyl)amino]-3-(3-morpholinopropyl)thiourea
CAS Name: 1-[3-(4-morpholinyl)propyl]-3-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]thiourea
IUPAC NAME: 1-(3-morpholin-4-ylpropyl)-3-[(4-propan-2-yloxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-(3-morpholin-4-ylpropyl)-3-[(4-propan-2-yloxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C18H28N4O3S
MOLECULAR WEIGHT: 380.50492
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)NNC(=S)NCCCN2CCOCC2
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Product OPENEYE NAME: methyl 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C18H27N2O4+
MOLECULAR WEIGHT: 335.41798
SMILES: COC1=CC=C(C=C1)CCNC(=O)C[NH+]2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C18H26N2O4
MOLECULAR WEIGHT: 334.41004
SMILES: COC1=CC=C(C=C1)CCNC(=O)CN2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: [2-(4-chloro-2-nitro-anilino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(4-chloro-2-nitroanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(4-chloro-2-nitroanilino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H13ClN2O6
MOLECULAR WEIGHT: 388.75862
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] (2R)-2-(4-chlorophenoxy)propanoate
CAS Name: (2R)-2-(4-chlorophenoxy)propanoic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] (2R)-2-(4-chlorophenoxy)propanoate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] (2R)-2-(4-chloranylphenoxy)propanoate
MOLECULAR FORMULA: C20H22ClNO5
MOLECULAR WEIGHT: 391.84538
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC(=O)[C@@H](C)OC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-[(4-isopropoxybenzoyl)amino]-3-(3-methylsulfanylpropyl)thiourea
CAS Name: 1-[3-(methylthio)propyl]-3-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]thiourea
IUPAC NAME: 1-(3-methylsulfanylpropyl)-3-[(4-propan-2-yloxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-(3-methylsulfanylpropyl)-3-[(4-propan-2-yloxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C15H23N3O2S2
MOLECULAR WEIGHT: 341.49202
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)NNC(=S)NCCCSC
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Product OPENEYE NAME: methyl 1-[2-(2,6-difluoroanilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate
CAS Name: 1-[2-(2,6-difluoroanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2,6-difluoroanilino)-2-oxoethyl]piperidin-1-ium-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate
MOLECULAR FORMULA: C15H19F2N2O3+
MOLECULAR WEIGHT: 313.319766
SMILES: COC(=O)C1CC[NH+](CC1)CC(=O)NC2=C(C=CC=C2F)F
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Product OPENEYE NAME: methyl 1-[2-(2,6-difluoroanilino)-2-oxo-ethyl]piperidine-4-carboxylate
CAS Name: 1-[2-(2,6-difluoroanilino)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2,6-difluoroanilino)-2-oxoethyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C15H18F2N2O3
MOLECULAR WEIGHT: 312.311826
SMILES: COC(=O)C1CCN(CC1)CC(=O)NC2=C(C=CC=C2F)F
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Product OPENEYE NAME: 1-(2-chloro-5-nitro-phenyl)-3-[(4-isopropoxybenzoyl)amino]thiourea
CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]thiourea
IUPAC NAME: 1-(2-chloro-5-nitrophenyl)-3-[(4-propan-2-yloxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-(2-chloranyl-5-nitro-phenyl)-3-[(4-propan-2-yloxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C17H17ClN4O4S
MOLECULAR WEIGHT: 408.85928
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)NNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl
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