Friday, November 2, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-(4-benzyloxyphenyl)-3-(5-ethylsulfonyl-2-hydroxy-phenyl)urea
CAS Name: 1-(5-ethylsulfonyl-2-hydroxyphenyl)-3-(4-phenylmethoxyphenyl)urea
IUPAC NAME: 1-(5-ethylsulfonyl-2-hydroxyphenyl)-3-(4-phenylmethoxyphenyl)urea
SYSTEMATIC NAME: 1-(5-ethylsulfonyl-2-oxidanyl-phenyl)-3-(4-phenylmethoxyphenyl)urea
MOLECULAR FORMULA: C22H22N2O5S
MOLECULAR WEIGHT: 426.48548
SMILES: CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: 1-(2,6-dibromo-4-isopropyl-phenyl)-3-(5-ethylsulfonyl-2-hydroxy-phenyl)urea
CAS Name: 1-(2,6-dibromo-4-propan-2-ylphenyl)-3-(5-ethylsulfonyl-2-hydroxyphenyl)urea
IUPAC NAME: 1-(2,6-dibromo-4-propan-2-ylphenyl)-3-(5-ethylsulfonyl-2-hydroxyphenyl)urea
SYSTEMATIC NAME: 1-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-3-(5-ethylsulfonyl-2-oxidanyl-phenyl)urea
MOLECULAR FORMULA: C18H20Br2N2O4S
MOLECULAR WEIGHT: 520.2354
SMILES: CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)NC2=C(C=C(C=C2Br)C(C)C)Br
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Product OPENEYE NAME: 1-(5-ethylsulfonyl-2-hydroxy-phenyl)-3-propyl-urea
CAS Name: 1-(5-ethylsulfonyl-2-hydroxyphenyl)-3-propylurea
IUPAC NAME: 1-(5-ethylsulfonyl-2-hydroxyphenyl)-3-propylurea
SYSTEMATIC NAME: 1-(5-ethylsulfonyl-2-oxidanyl-phenyl)-3-propyl-urea
MOLECULAR FORMULA: C12H18N2O4S
MOLECULAR WEIGHT: 286.34732
SMILES: CCCNC(=O)NC1=C(C=CC(=C1)S(=O)(=O)CC)O
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Product OPENEYE NAME: 1-(5-ethylsulfonyl-2-hydroxy-phenyl)-3-(2-methoxyphenyl)urea
CAS Name: 1-(5-ethylsulfonyl-2-hydroxyphenyl)-3-(2-methoxyphenyl)urea
IUPAC NAME: 1-(5-ethylsulfonyl-2-hydroxyphenyl)-3-(2-methoxyphenyl)urea
SYSTEMATIC NAME: 1-(5-ethylsulfonyl-2-oxidanyl-phenyl)-3-(2-methoxyphenyl)urea
MOLECULAR FORMULA: C16H18N2O5S
MOLECULAR WEIGHT: 350.38952
SMILES: CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)NC2=CC=CC=C2OC
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Product OPENEYE NAME: (4-hydroxy-1-piperidyl)-[3-[[4-(2-methoxyphenyl)-1-piperidyl]methyl]phenyl]methanone
CAS Name: (4-hydroxy-1-piperidinyl)-[3-[[4-(2-methoxyphenyl)-1-piperidinyl]methyl]phenyl]methanone
IUPAC NAME: (4-hydroxypiperidin-1-yl)-[3-[[4-(2-methoxyphenyl)piperidin-1-yl]methyl]phenyl]methanone
SYSTEMATIC NAME: [3-[[4-(2-methoxyphenyl)piperidin-1-yl]methyl]phenyl]-(4-oxidanylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C25H32N2O3
MOLECULAR WEIGHT: 408.53318
SMILES: COC1=CC=CC=C1C2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CCC(CC4)O
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Product OPENEYE NAME: [3-[(4-benzylpiperazin-1-yl)methyl]phenyl]-(4-hydroxy-1-piperidyl)methanone
CAS Name: (4-hydroxy-1-piperidinyl)-[3-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]methanone
IUPAC NAME: [3-[(4-benzylpiperazin-1-yl)methyl]phenyl]-(4-hydroxypiperidin-1-yl)methanone
SYSTEMATIC NAME: (4-oxidanylpiperidin-1-yl)-[3-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]methanone
MOLECULAR FORMULA: C24H31N3O2
MOLECULAR WEIGHT: 393.52184
SMILES: C1CN(CCC1O)C(=O)C2=CC(=CC=C2)CN3CCN(CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: methyl 3-[5-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)methyl]-2-furyl]thiophene-2-carboxylate
CAS Name: 3-[5-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)methyl]-2-furanyl]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[5-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)methyl]furan-2-yl]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[5-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)methyl]furan-2-yl]thiophene-2-carboxylate
MOLECULAR FORMULA: C21H21NO4S
MOLECULAR WEIGHT: 383.46074
SMILES: COC1=CC2=C(C=C1)N(CCC2)CC3=CC=C(O3)C4=C(SC=C4)C(=O)OC
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Product OPENEYE NAME: methyl 3-[5-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-2-furyl]thiophene-2-carboxylate
CAS Name: 3-[5-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-2-furanyl]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[5-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]furan-2-yl]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[5-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]furan-2-yl]thiophene-2-carboxylate
MOLECULAR FORMULA: C21H21NO3S
MOLECULAR WEIGHT: 367.46134
SMILES: CC1=CC2=C(C=C1)N(CCC2)CC3=CC=C(O3)C4=C(SC=C4)C(=O)OC
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Product OPENEYE NAME: 3-[[4-(2-methoxyphenyl)-1-piperidyl]methyl]-1H-indole
CAS Name: 3-[[4-(2-methoxyphenyl)-1-piperidinyl]methyl]-1H-indole
IUPAC NAME: 3-[[4-(2-methoxyphenyl)piperidin-1-yl]methyl]-1H-indole
SYSTEMATIC NAME: 3-[[4-(2-methoxyphenyl)piperidin-1-yl]methyl]-1H-indole
MOLECULAR FORMULA: C21H24N2O
MOLECULAR WEIGHT: 320.42806
SMILES: COC1=CC=CC=C1C2CCN(CC2)CC3=CNC4=CC=CC=C43
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Product OPENEYE NAME: N-(4-morpholinosulfonylphenyl)benzamide
CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
IUPAC NAME: N-(4-morpholin-4-ylsulfonylphenyl)benzamide
SYSTEMATIC NAME: N-(4-morpholin-4-ylsulfonylphenyl)benzamide
MOLECULAR FORMULA: C17H18N2O4S
MOLECULAR WEIGHT: 346.40082
SMILES: C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 2,5-dimethyl-N-(4-morpholinosulfonylphenyl)furan-3-carboxamide
CAS Name: 2,5-dimethyl-N-[4-(4-morpholinylsulfonyl)phenyl]-3-furancarboxamide
IUPAC NAME: 2,5-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)furan-3-carboxamide
SYSTEMATIC NAME: 2,5-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)furan-3-carboxamide
MOLECULAR FORMULA: C17H20N2O5S
MOLECULAR WEIGHT: 364.4161
SMILES: CC1=CC(=C(O1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3
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Product OPENEYE NAME: ethyl 1-[2-[(4-benzylpiperazin-1-yl)methyl]phenyl]piperidine-4-carboxylate
CAS Name: 1-[2-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[2-[(4-benzylpiperazin-1-yl)methyl]phenyl]piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-[2-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C26H35N3O2
MOLECULAR WEIGHT: 421.575
SMILES: CCOC(=O)C1CCN(CC1)C2=CC=CC=C2CN3CCN(CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: ethyl 1-[2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
CAS Name: 1-[2-[[4-(2-ethoxyphenyl)-1-piperazinyl]methyl]phenyl]-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-[2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C27H37N3O3
MOLECULAR WEIGHT: 451.60098
SMILES: CCOC1=CC=CC=C1N2CCN(CC2)CC3=CC=CC=C3N4CCC(CC4)C(=O)OCC
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Product OPENEYE NAME: ethyl 1-[2-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
CAS Name: 1-[2-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]phenyl]-4-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[2-[[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-[2-[[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]phenyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C25H30ClF3N4O2
MOLECULAR WEIGHT: 510.97951
SMILES: CCOC(=O)C1CCN(CC1)C2=CC=CC=C2CN3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl
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Product OPENEYE NAME: 1,2-dimethyl-N-(4-morpholinosulfonylphenyl)imidazole-4-sulfonamide
CAS Name: 1,2-dimethyl-N-[4-(4-morpholinylsulfonyl)phenyl]-4-imidazolesulfonamide
IUPAC NAME: 1,2-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)imidazole-4-sulfonamide
SYSTEMATIC NAME: 1,2-dimethyl-N-(4-morpholin-4-ylsulfonylphenyl)imidazole-4-sulfonamide
MOLECULAR FORMULA: C15H20N4O5S2
MOLECULAR WEIGHT: 400.4731
SMILES: CC1=NC(=CN1C)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3
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Product OPENEYE NAME: methyl 2,5-dimethyl-4-[(4-morpholinosulfonylphenyl)sulfamoyl]furan-3-carboxylate
CAS Name: 2,5-dimethyl-4-[[4-(4-morpholinylsulfonyl)phenyl]sulfamoyl]-3-furancarboxylic acid methyl ester
IUPAC NAME: methyl 2,5-dimethyl-4-[(4-morpholin-4-ylsulfonylphenyl)sulfamoyl]furan-3-carboxylate
SYSTEMATIC NAME: methyl 2,5-dimethyl-4-[(4-morpholin-4-ylsulfonylphenyl)sulfamoyl]furan-3-carboxylate
MOLECULAR FORMULA: C18H22N2O8S2
MOLECULAR WEIGHT: 458.50588
SMILES: CC1=C(C(=C(O1)C)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OC
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Product OPENEYE NAME: N-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2,5-dimethyl-furan-3-carboxamide
CAS Name: N-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2,5-dimethyl-3-furancarboxamide
IUPAC NAME: N-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2,5-dimethylfuran-3-carboxamide
SYSTEMATIC NAME: N-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-2,5-dimethyl-furan-3-carboxamide
MOLECULAR FORMULA: C15H17ClN2O4S
MOLECULAR WEIGHT: 356.82448
SMILES: CC1=CC(=C(O1)C)C(=O)NCCNS(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-4-fluoro-benzamide
CAS Name: N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-4-fluorobenzamide
IUPAC NAME: N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-4-fluorobenzamide
SYSTEMATIC NAME: N-[4-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]methyl]phenyl]-4-fluoranyl-benzamide
MOLECULAR FORMULA: C18H19FN2O3S
MOLECULAR WEIGHT: 362.418463
SMILES: C1CS(=O)(=O)CCN1CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-4-methoxy-benzamide
CAS Name: N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-4-methoxybenzamide
IUPAC NAME: N-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[4-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]methyl]phenyl]-4-methoxy-benzamide
MOLECULAR FORMULA: C19H22N2O4S
MOLECULAR WEIGHT: 374.45398
SMILES: COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN3CCS(=O)(=O)CC3
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Product OPENEYE NAME: N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
CAS Name: N-[2-methyl-4-phenyl-5-(trifluoromethyl)-3-pyrazolyl]benzamide
IUPAC NAME: N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
SYSTEMATIC NAME: N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
MOLECULAR FORMULA: C18H14F3N3O
MOLECULAR WEIGHT: 345.31847
SMILES: CN1C(=C(C(=N1)C(F)(F)F)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 4-fluoro-N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
CAS Name: 4-fluoro-N-[2-methyl-4-phenyl-5-(trifluoromethyl)-3-pyrazolyl]benzamide
IUPAC NAME: 4-fluoro-N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
SYSTEMATIC NAME: 4-fluoranyl-N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
MOLECULAR FORMULA: C18H13F4N3O
MOLECULAR WEIGHT: 363.308933
SMILES: CN1C(=C(C(=N1)C(F)(F)F)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 4-methoxy-N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
CAS Name: 4-methoxy-N-[2-methyl-4-phenyl-5-(trifluoromethyl)-3-pyrazolyl]benzamide
IUPAC NAME: 4-methoxy-N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
SYSTEMATIC NAME: 4-methoxy-N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide
MOLECULAR FORMULA: C19H16F3N3O2
MOLECULAR WEIGHT: 375.34445
SMILES: CN1C(=C(C(=N1)C(F)(F)F)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OC
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