Product OPENEYE NAME: N-ethyl-N-(1-hydroxy-2-oxo-3-pyridyl)-4-phenoxy-benzenesulfonamide
CAS Name: N-ethyl-N-(1-hydroxy-2-oxo-3-pyridinyl)-4-phenoxybenzenesulfonamide
IUPAC NAME: N-ethyl-N-(1-hydroxy-2-oxopyridin-3-yl)-4-phenoxybenzenesulfonamide
SYSTEMATIC NAME: N-ethyl-N-(1-oxidanyl-2-oxidanylidene-pyridin-3-yl)-4-phenoxy-benzenesulfonamide
MOLECULAR FORMULA: C19H18N2O5S
MOLECULAR WEIGHT: 386.42162
SMILES: CCN(C1=CC=CN(C1=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3
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Product OPENEYE NAME: N-(1-hydroxy-2-oxo-3-pyridyl)-N-isopropyl-4-phenoxy-benzenesulfonamide
CAS Name: N-(1-hydroxy-2-oxo-3-pyridinyl)-4-phenoxy-N-propan-2-ylbenzenesulfonamide
IUPAC NAME: N-(1-hydroxy-2-oxopyridin-3-yl)-4-phenoxy-N-propan-2-ylbenzenesulfonamide
SYSTEMATIC NAME: N-(1-oxidanyl-2-oxidanylidene-pyridin-3-yl)-4-phenoxy-N-propan-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C20H20N2O5S
MOLECULAR WEIGHT: 400.4482
SMILES: CC(C)N(C1=CC=CN(C1=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3
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Product OPENEYE NAME: N-[1-[[(1R)-1-[5-[3,5-dichloro-2-(2,2-difluoroethoxy)phenyl]-3-fluoro-2-pyridyl]ethyl]carbamoyl]cyclopropyl]isoxazole-5-carboxamide
CAS Name: N-[1-[[[(1R)-1-[5-[3,5-dichloro-2-(2,2-difluoroethoxy)phenyl]-3-fluoro-2-pyridinyl]ethyl]amino]-oxomethyl]cyclopropyl]-5-isoxazolecarboxamide
IUPAC NAME: N-[1-[[(1R)-1-[5-[3,5-dichloro-2-(2,2-difluoroethoxy)phenyl]-3-fluoropyridin-2-yl]ethyl]carbamoyl]cyclopropyl]-1,2-oxazole-5-carboxamide
SYSTEMATIC NAME: N-[1-[[(1R)-1-[5-[2-[2,2-bis(fluoranyl)ethoxy]-3,5-bis(chloranyl)phenyl]-3-fluoranyl-pyridin-2-yl]ethyl]carbamoyl]cyclopropyl]-1,2-oxazole-5-carboxamide
MOLECULAR FORMULA: C23H19Cl2F3N4O4
MOLECULAR WEIGHT: 543.32257
SMILES: C[C@H](C1=C(C=C(C=N1)C2=CC(=CC(=C2OCC(F)F)Cl)Cl)F)NC(=O)C3(CC3)NC(=O)C4=CC=NO4
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Product OPENEYE NAME: N1-[(1S,2R)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2R,4S)-4-isopropoxy-2-piperidyl]ethyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
CAS Name: N1-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-propan-2-yloxy-2-piperidinyl]propan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide
IUPAC NAME: 1-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-propan-2-yloxypiperidin-2-yl]propan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-oxidanyl-1-[(2R,4S)-4-propan-2-yloxypiperidin-2-yl]propan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C32H45F2N3O4
MOLECULAR WEIGHT: 573.714206
SMILES: CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@@H]([C@H]3C[C@H](CCN3)OC(C)C)O)C
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Product OPENEYE NAME: 1-[2-methoxy-2-(3-methoxyphenyl)cyclohexyl]-N-methyl-methanamine
CAS Name: 1-[2-methoxy-2-(3-methoxyphenyl)cyclohexyl]-N-methylmethanamine
IUPAC NAME: 1-[2-methoxy-2-(3-methoxyphenyl)cyclohexyl]-N-methylmethanamine
SYSTEMATIC NAME: 1-[2-methoxy-2-(3-methoxyphenyl)cyclohexyl]-N-methyl-methanamine
MOLECULAR FORMULA: C16H25NO2
MOLECULAR WEIGHT: 263.3752
SMILES: CNCC1CCCCC1(C2=CC(=CC=C2)OC)OC
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Product OPENEYE NAME: 3,6-bis[3-(trifluoromethyl)phenyl]-1,2,4,5-tetraoxane
CAS Name: 3,6-bis[3-(trifluoromethyl)phenyl]-1,2,4,5-tetraoxane
IUPAC NAME: 3,6-bis[3-(trifluoromethyl)phenyl]-1,2,4,5-tetraoxane
SYSTEMATIC NAME: 3,6-bis[3-(trifluoromethyl)phenyl]-1,2,4,5-tetraoxane
MOLECULAR FORMULA: C16H10F6O4
MOLECULAR WEIGHT: 380.238619
SMILES: C1=CC(=CC(=C1)C(F)(F)F)C2OOC(OO2)C3=CC(=CC=C3)C(F)(F)F
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Product OPENEYE NAME: 3,6-bis(2-chlorophenyl)-1,2,4,5-tetraoxane
CAS Name: 3,6-bis(2-chlorophenyl)-1,2,4,5-tetraoxane
IUPAC NAME: 3,6-bis(2-chlorophenyl)-1,2,4,5-tetraoxane
SYSTEMATIC NAME: 3,6-bis(2-chlorophenyl)-1,2,4,5-tetraoxane
MOLECULAR FORMULA: C14H10Cl2O4
MOLECULAR WEIGHT: 313.1328
SMILES: C1=CC=C(C(=C1)C2OOC(OO2)C3=CC=CC=C3Cl)Cl
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Product OPENEYE NAME: N-cyano-4-[3-(3,4-dimethoxyphenyl)propanoyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine
CAS Name: N-cyano-4-[3-(3,4-dimethoxyphenyl)-1-oxopropyl]-N'-(2-methylphenyl)-3-phenyl-1-piperazinecarboximidamide
IUPAC NAME: N-cyano-4-[3-(3,4-dimethoxyphenyl)propanoyl]-N'-(2-methylphenyl)-3-phenylpiperazine-1-carboximidamide
SYSTEMATIC NAME: N-cyano-4-[3-(3,4-dimethoxyphenyl)propanoyl]-N'-(2-methylphenyl)-3-phenyl-piperazine-1-carboximidamide
MOLECULAR FORMULA: C30H33N5O3
MOLECULAR WEIGHT: 511.61472
SMILES: CC1=CC=CC=C1N=C(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)CCC4=CC(=C(C=C4)OC)OC
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Product OPENEYE NAME: 1-[3-[(1R,5S)-3-(5-acetyl-2-ethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-1-phenyl-3-(p-tolyl)urea
CAS Name: 1-[3-[(1R,5S)-3-(5-acetyl-2-ethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenylurea
IUPAC NAME: 1-[3-[(1R,5S)-3-(5-acetyl-2-ethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenylurea
SYSTEMATIC NAME: 1-[3-[(1R,5S)-3-(5-ethanoyl-2-ethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenyl-urea
MOLECULAR FORMULA: C34H44N6O2
MOLECULAR WEIGHT: 568.75216
SMILES: CCC1=NC2=C(N1C3C[C@H]4CC[C@@H](C3)N4CCCN(C5=CC=CC=C5)C(=O)NC6=CC=C(C=C6)C)CCN(C2)C(=O)C
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Product OPENEYE NAME: 3-cyclohexyl-4-(2-isopropoxyphenyl)-5-methyl-1H-imidazol-2-one
CAS Name: 3-cyclohexyl-5-methyl-4-(2-propan-2-yloxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 3-cyclohexyl-5-methyl-4-(2-propan-2-yloxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3-cyclohexyl-5-methyl-4-(2-propan-2-yloxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C19H26N2O2
MOLECULAR WEIGHT: 314.42194
SMILES: CC1=C(N(C(=O)N1)C2CCCCC2)C3=CC=CC=C3OC(C)C
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Product OPENEYE NAME: 1-[3-[(1R,5S)-3-(5-acetyl-2-isopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-1-phenyl-3-(p-tolyl)urea
CAS Name: 1-[3-[(1R,5S)-3-(5-acetyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenylurea
IUPAC NAME: 1-[3-[(1R,5S)-3-(5-acetyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenylurea
SYSTEMATIC NAME: 1-[3-[(1R,5S)-3-(5-ethanoyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenyl-urea
MOLECULAR FORMULA: C35H46N6O2
MOLECULAR WEIGHT: 582.77874
SMILES: CC1=CC=C(C=C1)NC(=O)N(CCCN2[C@@H]3CC[C@H]2CC(C3)N4C5=C(CN(CC5)C(=O)C)N=C4C(C)C)C6=CC=CC=C6
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Product OPENEYE NAME: N-cyano-4-(3,4-dimethoxybenzoyl)-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine
CAS Name: N-cyano-4-[(3,4-dimethoxyphenyl)-oxomethyl]-N'-(2-methylphenyl)-3-phenyl-1-piperazinecarboximidamide
IUPAC NAME: N-cyano-4-(3,4-dimethoxybenzoyl)-N'-(2-methylphenyl)-3-phenylpiperazine-1-carboximidamide
SYSTEMATIC NAME: N-cyano-4-(3,4-dimethoxyphenyl)carbonyl-N'-(2-methylphenyl)-3-phenyl-piperazine-1-carboximidamide
MOLECULAR FORMULA: C28H29N5O3
MOLECULAR WEIGHT: 483.56156
SMILES: CC1=CC=CC=C1N=C(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)OC)OC
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Product OPENEYE NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1S)-1-(3-ethyl-3-hydroxy-pentyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
CAS Name: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1S)-1-[(3-ethyl-3-hydroxypentyl)thio]ethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
IUPAC NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1S)-1-(3-ethyl-3-hydroxypentyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
SYSTEMATIC NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1S)-1-(3-ethyl-3-oxidanyl-pentyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
MOLECULAR FORMULA: C27H44O3S
MOLECULAR WEIGHT: 448.70146
SMILES: CCC(CC)(CCS[C@@H](C)C1=CCC\2[C@@]1(CCC/C2=C\C=C3C[C@H](C[C@@H](C3)O)O)C)O
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Product OPENEYE NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-(2-ethyl-2-hydroxy-butyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
CAS Name: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-[(2-ethyl-2-hydroxybutyl)thio]ethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
IUPAC NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-(2-ethyl-2-hydroxybutyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
SYSTEMATIC NAME: (1R,3R)-5-[(2E)-2-[(7aS)-1-[(1R)-1-(2-ethyl-2-oxidanyl-butyl)sulfanylethyl]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
MOLECULAR FORMULA: C26H42O3S
MOLECULAR WEIGHT: 434.67488
SMILES: CCC(CC)(CS[C@H](C)C1=CCC\2[C@@]1(CCC/C2=C\C=C3C[C@H](C[C@@H](C3)O)O)C)O
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Product OPENEYE NAME: dimethyl 1-[5-[[(6aS,8S)-8-[4,5-bis(methoxycarbonyl)triazol-1-yl]-2-methoxy-11-oxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]pentyl]triazole-4,5-dicarboxylate
CAS Name: 1-[5-[[(6aS,8S)-8-[4,5-bis(methoxycarbonyl)-1-triazolyl]-2-methoxy-11-oxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]pentyl]triazole-4,5-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 1-[5-[[(6aS,8S)-8-[4,5-bis(methoxycarbonyl)triazol-1-yl]-2-methoxy-11-oxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]pentyl]triazole-4,5-dicarboxylate
SYSTEMATIC NAME: dimethyl 1-[5-[[(6aS,8S)-8-[4,5-bis(methoxycarbonyl)-1,2,3-triazol-1-yl]-2-methoxy-11-oxidanylidene-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]pentyl]-1,2,3-triazole-4,5-dicarboxylate
MOLECULAR FORMULA: C30H34N8O11
MOLECULAR WEIGHT: 682.63796
SMILES: COC1=C(C=C2C(=C1)C(=O)N3C[C@H](C[C@H]3C=N2)N4C(=C(N=N4)C(=O)OC)C(=O)OC)OCCCCCN5C(=C(N=N5)C(=O)OC)C(=O)OC
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Product OPENEYE NAME: 2-cyclohexyl-2-hydroxy-2-phenyl-N-[(1S,5R)-3-(p-tolyl)-3-azabicyclo[3.1.0]hexan-6-yl]acetamide
CAS Name: 2-cyclohexyl-2-hydroxy-N-[(1S,5R)-3-(4-methylphenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-2-phenylacetamide
IUPAC NAME: 2-cyclohexyl-2-hydroxy-N-[(1S,5R)-3-(4-methylphenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-2-phenylacetamide
SYSTEMATIC NAME: 2-cyclohexyl-N-[(1S,5R)-3-(4-methylphenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-2-oxidanyl-2-phenyl-ethanamide
MOLECULAR FORMULA: C26H32N2O2
MOLECULAR WEIGHT: 404.54448
SMILES: CC1=CC=C(C=C1)N2C[C@@H]3[C@H](C2)C3NC(=O)C(C4CCCCC4)(C5=CC=CC=C5)O
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Product OPENEYE NAME: 2-[5-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1H-pyrazol-3-yl]ethanol
CAS Name: 2-[5-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-1H-pyrazol-3-yl]ethanol
IUPAC NAME: 2-[5-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1H-pyrazol-3-yl]ethanol
SYSTEMATIC NAME: 2-[5-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1H-pyrazol-3-yl]ethanol
MOLECULAR FORMULA: C12H17N5O
MOLECULAR WEIGHT: 247.29628
SMILES: CC1=C(NN=C1CCO)CC2=CN=C(N=C2N)C
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Product OPENEYE NAME: 5-[3-(2-furyl)propanoylamino]-2-morpholino-benzoic acid
CAS Name: 5-[[3-(2-furanyl)-1-oxopropyl]amino]-2-(4-morpholinyl)benzoic acid
IUPAC NAME: 5-[3-(furan-2-yl)propanoylamino]-2-morpholin-4-ylbenzoic acid
SYSTEMATIC NAME: 5-[3-(furan-2-yl)propanoylamino]-2-morpholin-4-yl-benzoic acid
MOLECULAR FORMULA: C18H20N2O5
MOLECULAR WEIGHT: 344.3618
SMILES: C1COCCN1C2=C(C=C(C=C2)NC(=O)CCC3=CC=CO3)C(=O)O
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Product OPENEYE NAME: N-[4-[(5-chloro-1H-indole-2-carbonyl)amino]-1-propanoyl-3-piperidyl]-5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carboxamide
CAS Name: N-[4-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-1-(1-oxopropyl)-3-piperidinyl]-5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2-carboxamide
IUPAC NAME: N-[4-[(5-chloro-1H-indole-2-carbonyl)amino]-1-propanoylpiperidin-3-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
SYSTEMATIC NAME: N-[4-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-1-propanoyl-piperidin-3-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
MOLECULAR FORMULA: C25H29ClN6O3S
MOLECULAR WEIGHT: 529.05416
SMILES: CCC(=O)N1CCC(C(C1)NC(=O)C2=NC3=C(S2)CN(CC3)C)NC(=O)C4=CC5=C(N4)C=CC(=C5)Cl
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