Product OPENEYE NAME: N-(1-adamantyl)-2-(p-tolyl)quinoline-4-carboxamide
CAS Name: N-(1-adamantyl)-2-(4-methylphenyl)-4-quinolinecarboxamide
IUPAC NAME: N-(1-adamantyl)-2-(4-methylphenyl)quinoline-4-carboxamide
SYSTEMATIC NAME: N-(1-adamantyl)-2-(4-methylphenyl)quinoline-4-carboxamide
MOLECULAR FORMULA: C27H28N2O
MOLECULAR WEIGHT: 396.52402
SMILES: CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC45CC6CC(C4)CC(C6)C5
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Product OPENEYE NAME: 2-[(4-chloro-3-nitro-benzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
IUPAC NAME: 2-[(4-chloro-3-nitrobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
SYSTEMATIC NAME: 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
MOLECULAR FORMULA: C18H18ClN3O4S
MOLECULAR WEIGHT: 407.87122
SMILES: C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)N
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Product OPENEYE NAME: 2-[(4-bromo-2-fluoro-phenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
CAS Name: 2-[(4-bromo-2-fluoroanilino)-oxomethyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
IUPAC NAME: 2-[(4-bromo-2-fluorophenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
SYSTEMATIC NAME: 2-[(4-bromanyl-2-fluoranyl-phenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid
MOLECULAR FORMULA: C14H11BrFNO4
MOLECULAR WEIGHT: 356.143843
SMILES: C1=CC2C(C(C1O2)C(=O)NC3=C(C=C(C=C3)Br)F)C(=O)O
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Product OPENEYE NAME: N-[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-oxo-chromene-3-carboxamide
CAS Name: N-[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C20H15N3O6
MOLECULAR WEIGHT: 393.3496
SMILES: COC1=CC(=CC(=C1)C2=NN=C(O2)NC(=O)C3=CC4=CC=CC=C4OC3=O)OC
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Product OPENEYE NAME: 1-(1-methylimidazo[1,5-a]quinoxalin-4-yl)piperidin-4-ol
CAS Name: 1-(1-methyl-4-imidazo[1,5-a]quinoxalinyl)-4-piperidinol
IUPAC NAME: 1-(1-methylimidazo[1,5-a]quinoxalin-4-yl)piperidin-4-ol
SYSTEMATIC NAME: 1-(1-methylimidazo[1,5-a]quinoxalin-4-yl)piperidin-4-ol
MOLECULAR FORMULA: C16H18N4O
MOLECULAR WEIGHT: 282.34032
SMILES: CC1=NC=C2N1C3=CC=CC=C3N=C2N4CCC(CC4)O
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Product OPENEYE NAME: [2-[(benzoylhydrazono)methyl]-4-bromo-phenyl] 4-nitrobenzoate
CAS Name: 4-nitrobenzoic acid [2-[(benzoylhydrazinylidene)methyl]-4-bromophenyl] ester
IUPAC NAME: [2-[(benzoylhydrazinylidene)methyl]-4-bromophenyl] 4-nitrobenzoate
SYSTEMATIC NAME: [4-bromanyl-2-[(phenylcarbonylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate
MOLECULAR FORMULA: C21H14BrN3O5
MOLECULAR WEIGHT: 468.25696
SMILES: C1=CC=C(C=C1)C(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: N-(5-methyl-6-nitro-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)nitramide
CAS Name: N-(5-methyl-6-nitro-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)nitramide
IUPAC NAME: N-(5-methyl-6-nitro-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)nitramide
SYSTEMATIC NAME: N-(5-methyl-6-nitro-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)nitramide
MOLECULAR FORMULA: C6H5N7O5
MOLECULAR WEIGHT: 255.1478
SMILES: CC1=C(C(=O)N2C(=N1)N=C(N2)N[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 5-(5-chloro-1,3-benzoxazol-2-yl)-N,N-dimethyl-pyrimidin-2-amine
CAS Name: 5-(5-chloro-1,3-benzoxazol-2-yl)-N,N-dimethyl-2-pyrimidinamine
IUPAC NAME: 5-(5-chloro-1,3-benzoxazol-2-yl)-N,N-dimethylpyrimidin-2-amine
SYSTEMATIC NAME: 5-(5-chloranyl-1,3-benzoxazol-2-yl)-N,N-dimethyl-pyrimidin-2-amine
MOLECULAR FORMULA: C13H11ClN4O
MOLECULAR WEIGHT: 274.70564
SMILES: CN(C)C1=NC=C(C=N1)C2=NC3=C(O2)C=CC(=C3)Cl
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Product OPENEYE NAME: 5-[(2-hydroxyphenyl)-(2,4,6-trioxo-1-phenyl-hexahydropyrimidin-5-yl)methyl]-1-phenyl-hexahydropyrimidine-2,4,6-trione
CAS Name: 5-[(2-hydroxyphenyl)-(2,4,6-trioxo-1-phenyl-1,3-diazinan-5-yl)methyl]-1-phenyl-1,3-diazinane-2,4,6-trione
IUPAC NAME: 5-[(2-hydroxyphenyl)-(2,4,6-trioxo-1-phenyl-1,3-diazinan-5-yl)methyl]-1-phenyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-[(2-hydroxyphenyl)-[2,4,6-tris(oxidanylidene)-1-phenyl-1,3-diazinan-5-yl]methyl]-1-phenyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C27H20N4O7
MOLECULAR WEIGHT: 512.4703
SMILES: C1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)C(C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5O
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Product OPENEYE NAME: 2-[(1-bromo-2-naphthyl)oxy]-N-(2-naphthylmethyleneamino)acetamide
CAS Name: 2-[(1-bromo-2-naphthalenyl)oxy]-N-(2-naphthalenylmethylideneamino)acetamide
IUPAC NAME: 2-(1-bromonaphthalen-2-yl)oxy-N-(naphthalen-2-ylmethylideneamino)acetamide
SYSTEMATIC NAME: 2-(1-bromanylnaphthalen-2-yl)oxy-N-(naphthalen-2-ylmethylideneamino)ethanamide
MOLECULAR FORMULA: C23H17BrN2O2
MOLECULAR WEIGHT: 433.29728
SMILES: C1=CC=C2C=C(C=CC2=C1)C=NNC(=O)COC3=C(C4=CC=CC=C4C=C3)Br
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Product OPENEYE NAME: 4-(4-tetradecylphenyl)azonaphthalen-1-amine
CAS Name: 4-(4-tetradecylphenyl)azo-1-naphthalenamine
IUPAC NAME: 4-[(4-tetradecylphenyl)diazenyl]naphthalen-1-amine
SYSTEMATIC NAME: 4-[(4-tetradecylphenyl)diazenyl]naphthalen-1-amine
MOLECULAR FORMULA: C30H41N3
MOLECULAR WEIGHT: 443.66664
SMILES: CCCCCCCCCCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H41N3O
MOLECULAR WEIGHT: 471.67674
SMILES: CC1(CC(C2=C(C1)CC3(CC(CC2(C3)O)(C)C)C)N=C(NC4=CC=CC=C4)NC5=CC=CC=C5)C
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Product OPENEYE NAME: [3,5-ditert-butyl-2-(3-phenylprop-2-enoyloxy)phenyl] 3-phenylprop-2-enoate
CAS Name: 3-phenyl-2-propenoic acid [3,5-ditert-butyl-2-(1-oxo-3-phenylprop-2-enoxy)phenyl] ester
IUPAC NAME: [3,5-ditert-butyl-2-(3-phenylprop-2-enoyloxy)phenyl] 3-phenylprop-2-enoate
SYSTEMATIC NAME: [3,5-ditert-butyl-2-(3-phenylprop-2-enoyloxy)phenyl] 3-phenylprop-2-enoate
MOLECULAR FORMULA: C32H34O4
MOLECULAR WEIGHT: 482.60996
SMILES: CC(C)(C)C1=CC(=C(C(=C1)OC(=O)C=CC2=CC=CC=C2)OC(=O)C=CC3=CC=CC=C3)C(C)(C)C
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Product OPENEYE NAME: 1-(diaminomethylene)-2-[4-(trifluoromethylsulfanyl)phenyl]guanidine
CAS Name: 1-(diaminomethylidene)-2-[4-(trifluoromethylthio)phenyl]guanidine
IUPAC NAME: 1-(diaminomethylidene)-2-[4-(trifluoromethylsulfanyl)phenyl]guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-[4-(trifluoromethylsulfanyl)phenyl]guanidine
MOLECULAR FORMULA: C9H10F3N5S
MOLECULAR WEIGHT: 277.26941
SMILES: C1=CC(=CC=C1N=C(N)N=C(N)N)SC(F)(F)F
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Product OPENEYE NAME: 2-[(2,4-dichlorophenyl)methylsulfanyl]-6-(4-propoxyphenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile
CAS Name: 2-[(2,4-dichlorophenyl)methylthio]-6-(4-propoxyphenyl)-4-(trifluoromethyl)-3-pyridinecarbonitrile
IUPAC NAME: 2-[(2,4-dichlorophenyl)methylsulfanyl]-6-(4-propoxyphenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile
SYSTEMATIC NAME: 2-[(2,4-dichlorophenyl)methylsulfanyl]-6-(4-propoxyphenyl)-4-(trifluoromethyl)pyridine-3-carbonitrile
MOLECULAR FORMULA: C23H17Cl2F3N2OS
MOLECULAR WEIGHT: 497.36009
SMILES: CCCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC3=C(C=C(C=C3)Cl)Cl
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Product OPENEYE NAME: 2-(4-methylanilino)-N-[(5-nitro-2-thienyl)methyleneamino]butanamide
CAS Name: 2-(4-methylanilino)-N-[(5-nitro-2-thiophenyl)methylideneamino]butanamide
IUPAC NAME: 2-(4-methylanilino)-N-[(5-nitrothiophen-2-yl)methylideneamino]butanamide
SYSTEMATIC NAME: 2-[(4-methylphenyl)amino]-N-[(5-nitrothiophen-2-yl)methylideneamino]butanamide
MOLECULAR FORMULA: C16H18N4O3S
MOLECULAR WEIGHT: 346.40412
SMILES: CCC(C(=O)NN=CC1=CC=C(S1)[N+](=O)[O-])NC2=CC=C(C=C2)C
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Product OPENEYE NAME: (4-chloro-2,5-dimethoxy-phenyl)-(4-fluorophenyl)sulfonyl-azanide
CAS Name: (4-chloro-2,5-dimethoxyphenyl)-(4-fluorophenyl)sulfonylazanide
IUPAC NAME: (4-chloro-2,5-dimethoxyphenyl)-(4-fluorophenyl)sulfonylazanide
SYSTEMATIC NAME: (4-chloranyl-2,5-dimethoxy-phenyl)-(4-fluorophenyl)sulfonyl-azanide
MOLECULAR FORMULA: C14H12ClFNO4S-
MOLECULAR WEIGHT: 344.765783
SMILES: COC1=CC(=C(C=C1[N-]S(=O)(=O)C2=CC=C(C=C2)F)OC)Cl
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Product OPENEYE NAME: N-(6-bromo-9-ethyl-3,4-dihydrocarbazol-1-yl)hydroxylamine
CAS Name: N-(6-bromo-9-ethyl-3,4-dihydrocarbazol-1-yl)hydroxylamine
IUPAC NAME: N-(6-bromo-9-ethyl-3,4-dihydrocarbazol-1-yl)hydroxylamine
SYSTEMATIC NAME: N-(6-bromanyl-9-ethyl-3,4-dihydrocarbazol-1-yl)hydroxylamine
MOLECULAR FORMULA: C14H15BrN2O
MOLECULAR WEIGHT: 307.1857
SMILES: CCN1C2=C(C=C(C=C2)Br)C3=C1C(=CCC3)NO
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Product OPENEYE NAME: [6-(4-fluorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-methoxy-methanolate
CAS Name: [6-(4-fluorophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-methoxymethanolate
IUPAC NAME: [6-(4-fluorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-methoxymethanolate
SYSTEMATIC NAME: [6-(4-fluorophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-methoxy-methanolate
MOLECULAR FORMULA: C14H11FNO4S-
MOLECULAR WEIGHT: 308.304843
SMILES: COC(=C1C=CC=CC1=NS(=O)(=O)C2=CC=C(C=C2)F)[O-]
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Product OPENEYE NAME: ethyl 3-[[2-(4-tert-butylphenyl)sulfonyl-2-cyano-vinyl]amino]benzoate
CAS Name: 3-[[2-(4-tert-butylphenyl)sulfonyl-2-cyanoethenyl]amino]benzoic acid ethyl ester
IUPAC NAME: ethyl 3-[[2-(4-tert-butylphenyl)sulfonyl-2-cyanoethenyl]amino]benzoate
SYSTEMATIC NAME: ethyl 3-[[2-(4-tert-butylphenyl)sulfonyl-2-cyano-ethenyl]amino]benzoate
MOLECULAR FORMULA: C22H24N2O4S
MOLECULAR WEIGHT: 412.50196
SMILES: CCOC(=O)C1=CC(=CC=C1)NC=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C
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