Friday, March 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-[2-(3-hydroxyanilino)thiazol-4-yl]-6-methoxy-chromen-2-one
CAS Name: 3-[2-(3-hydroxyanilino)-4-thiazolyl]-6-methoxy-1-benzopyran-2-one
IUPAC NAME: 3-[2-(3-hydroxyanilino)-1,3-thiazol-4-yl]-6-methoxychromen-2-one
SYSTEMATIC NAME: 3-[2-[(3-hydroxyphenyl)amino]-1,3-thiazol-4-yl]-6-methoxy-chromen-2-one
MOLECULAR FORMULA: C19H14N2O4S
MOLECULAR WEIGHT: 366.39046
SMILES: COC1=CC2=C(C=C1)OC(=O)C(=C2)C3=CSC(=N3)NC4=CC(=CC=C4)O
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Product OPENEYE NAME: 3-[2-(3-hydroxyanilino)thiazol-4-yl]-8-methoxy-chromen-2-one
CAS Name: 3-[2-(3-hydroxyanilino)-4-thiazolyl]-8-methoxy-1-benzopyran-2-one
IUPAC NAME: 3-[2-(3-hydroxyanilino)-1,3-thiazol-4-yl]-8-methoxychromen-2-one
SYSTEMATIC NAME: 3-[2-[(3-hydroxyphenyl)amino]-1,3-thiazol-4-yl]-8-methoxy-chromen-2-one
MOLECULAR FORMULA: C19H14N2O4S
MOLECULAR WEIGHT: 366.39046
SMILES: COC1=CC=CC2=C1OC(=O)C(=C2)C3=CSC(=N3)NC4=CC(=CC=C4)O
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Product OPENEYE NAME: N-benzyl-8-methoxy-6-nitro-2-oxo-chromene-3-carboxamide
CAS Name: 8-methoxy-6-nitro-2-oxo-N-(phenylmethyl)-1-benzopyran-3-carboxamide
IUPAC NAME: N-benzyl-8-methoxy-6-nitro-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: 8-methoxy-6-nitro-2-oxidanylidene-N-(phenylmethyl)chromene-3-carboxamide
MOLECULAR FORMULA: C18H14N2O6
MOLECULAR WEIGHT: 354.31356
SMILES: COC1=C2C(=CC(=C1)[N+](=O)[O-])C=C(C(=O)O2)C(=O)NCC3=CC=CC=C3
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Product OPENEYE NAME: N-(2-ethoxyphenyl)-8-methoxy-6-nitro-2-oxo-chromene-3-carboxamide
CAS Name: N-(2-ethoxyphenyl)-8-methoxy-6-nitro-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-(2-ethoxyphenyl)-8-methoxy-6-nitro-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-(2-ethoxyphenyl)-8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C19H16N2O7
MOLECULAR WEIGHT: 384.33954
SMILES: CCOC1=CC=CC=C1NC(=O)C2=CC3=CC(=CC(=C3OC2=O)OC)[N+](=O)[O-]
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 6-nitro-2-oxo-chromene-3-carboxylate
CAS Name: 6-nitro-2-oxo-1-benzopyran-3-carboxylic acid [(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl] 6-nitro-2-oxochromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-nitro-2-oxidanylidene-chromene-3-carboxylate
MOLECULAR FORMULA: C20H15NO7
MOLECULAR WEIGHT: 381.3356
SMILES: CC1=CC=C(C=C1)C(=O)[C@@H](C)OC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 6-nitro-2-oxo-chromene-3-carboxylate
CAS Name: 6-nitro-2-oxo-1-benzopyran-3-carboxylic acid [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] 6-nitro-2-oxochromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-nitro-2-oxidanylidene-chromene-3-carboxylate
MOLECULAR FORMULA: C20H15NO7
MOLECULAR WEIGHT: 381.3356
SMILES: CC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O
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Product OPENEYE NAME: N-(3-fluorophenyl)-6-methoxy-2-oxo-chromene-3-carboxamide
CAS Name: N-(3-fluorophenyl)-6-methoxy-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-(3-fluorophenyl)-6-methoxy-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-(3-fluorophenyl)-6-methoxy-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C17H12FNO4
MOLECULAR WEIGHT: 313.279883
SMILES: COC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)NC3=CC(=CC=C3)F
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Product OPENEYE NAME: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-8-methoxy-chromen-2-one
CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-8-methoxy-1-benzopyran-2-one
IUPAC NAME: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-8-methoxychromen-2-one
SYSTEMATIC NAME: 3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one
MOLECULAR FORMULA: C21H19ClN2O4
MOLECULAR WEIGHT: 398.83956
SMILES: COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl
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Product OPENEYE NAME: N-(4-chloro-2,5-dimethoxy-phenyl)-8-methoxy-2-oxo-chromene-3-carboxamide
CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-8-methoxy-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-(4-chloro-2,5-dimethoxyphenyl)-8-methoxy-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-(4-chloranyl-2,5-dimethoxy-phenyl)-8-methoxy-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C19H16ClNO6
MOLECULAR WEIGHT: 389.78644
SMILES: COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=CC(=C(C=C3OC)Cl)OC
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Product OPENEYE NAME: N-(4-chloro-2,5-dimethoxy-phenyl)-6-methoxy-2-oxo-chromene-3-carboxamide
CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-6-methoxy-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-(4-chloro-2,5-dimethoxyphenyl)-6-methoxy-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-(4-chloranyl-2,5-dimethoxy-phenyl)-6-methoxy-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C19H16ClNO6
MOLECULAR WEIGHT: 389.78644
SMILES: COC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)NC3=CC(=C(C=C3OC)Cl)OC
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Product OPENEYE NAME: [2-oxo-2-(2-thienyl)ethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester
IUPAC NAME: (2-oxo-2-thiophen-2-ylethyl) 1,2,3,4-tetrahydroacridine-9-carboxylate
SYSTEMATIC NAME: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 1,2,3,4-tetrahydroacridine-9-carboxylate
MOLECULAR FORMULA: C20H17NO3S
MOLECULAR WEIGHT: 351.41888
SMILES: C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)C4=CC=CS4
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Product OPENEYE NAME: N-(2-hydroxyphenyl)-8-methoxy-2-oxo-chromene-3-carboxamide
CAS Name: N-(2-hydroxyphenyl)-8-methoxy-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-(2-hydroxyphenyl)-8-methoxy-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-(2-hydroxyphenyl)-8-methoxy-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C17H13NO5
MOLECULAR WEIGHT: 311.28882
SMILES: COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=CC=CC=C3O
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Product OPENEYE NAME: 5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
CAS Name: 5-(4-chlorophenyl)-3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1,2,4-oxadiazole
IUPAC NAME: 5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C15H13ClN4OS
MOLECULAR WEIGHT: 332.80792
SMILES: CC1=CC(=NC(=N1)SCC2=NOC(=N2)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: 6-amino-2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1H-pyrimidin-4-one
CAS Name: 6-amino-2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylthio]-1H-pyrimidin-4-one
IUPAC NAME: 6-amino-2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-azanyl-2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1H-pyrimidin-4-one
MOLECULAR FORMULA: C13H10ClN5O2S
MOLECULAR WEIGHT: 335.7688
SMILES: C1=CC(=CC=C1C2=NC(=NO2)CSC3=NC(=O)C=C(N3)N)Cl
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Product OPENEYE NAME: N-(2,5-dichlorophenyl)-N-[2-oxo-2-(1-piperidyl)ethyl]methanesulfonamide
CAS Name: N-(2,5-dichlorophenyl)-N-[2-oxo-2-(1-piperidinyl)ethyl]methanesulfonamide
IUPAC NAME: N-(2,5-dichlorophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
SYSTEMATIC NAME: N-[2,5-bis(chloranyl)phenyl]-N-(2-oxidanylidene-2-piperidin-1-yl-ethyl)methanesulfonamide
MOLECULAR FORMULA: C14H18Cl2N2O3S
MOLECULAR WEIGHT: 365.27532
SMILES: CS(=O)(=O)N(CC(=O)N1CCCCC1)C2=C(C=CC(=C2)Cl)Cl
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Product OPENEYE NAME: (2S)-2-(N-methylsulfonyl-4-phenoxy-anilino)-N-(3-pyridyl)propanamide
CAS Name: (2S)-2-(N-methylsulfonyl-4-phenoxyanilino)-N-(3-pyridinyl)propanamide
IUPAC NAME: (2S)-2-(N-methylsulfonyl-4-phenoxyanilino)-N-pyridin-3-ylpropanamide
SYSTEMATIC NAME: (2S)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-pyridin-3-yl-propanamide
MOLECULAR FORMULA: C21H21N3O4S
MOLECULAR WEIGHT: 411.47414
SMILES: C[C@@H](C(=O)NC1=CN=CC=C1)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C
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Product OPENEYE NAME: (2R)-2-(N-methylsulfonyl-4-phenoxy-anilino)-N-(3-pyridyl)propanamide
CAS Name: (2R)-2-(N-methylsulfonyl-4-phenoxyanilino)-N-(3-pyridinyl)propanamide
IUPAC NAME: (2R)-2-(N-methylsulfonyl-4-phenoxyanilino)-N-pyridin-3-ylpropanamide
SYSTEMATIC NAME: (2R)-2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-pyridin-3-yl-propanamide
MOLECULAR FORMULA: C21H21N3O4S
MOLECULAR WEIGHT: 411.47414
SMILES: C[C@H](C(=O)NC1=CN=CC=C1)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C
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Product OPENEYE NAME: ethyl 1-[2-(3,5-dichloro-N-methylsulfonyl-anilino)acetyl]piperidine-4-carboxylate
CAS Name: 1-[2-(3,5-dichloro-N-methylsulfonylanilino)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[2-(3,5-dichloro-N-methylsulfonylanilino)acetyl]piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-[2-[[3,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H22Cl2N2O5S
MOLECULAR WEIGHT: 437.33798
SMILES: CCOC(=O)C1CCN(CC1)C(=O)CN(C2=CC(=CC(=C2)Cl)Cl)S(=O)(=O)C
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