Monday, March 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 5-[(R)-hydroxy(phenyl)methyl]-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione
CAS Name: 5-[(R)-hydroxy(phenyl)methyl]-2-(4-morpholinylmethyl)-4-phenyl-1,2,4-triazole-3-thione
IUPAC NAME: 5-[(R)-hydroxy(phenyl)methyl]-2-(morpholin-4-ylmethyl)-4-phenyl-1,2,4-triazole-3-thione
SYSTEMATIC NAME: 2-(morpholin-4-ylmethyl)-5-[(R)-oxidanyl(phenyl)methyl]-4-phenyl-1,2,4-triazole-3-thione
MOLECULAR FORMULA: C20H22N4O2S
MOLECULAR WEIGHT: 382.47928
SMILES: C1COCCN1CN2C(=S)N(C(=N2)[C@@H](C3=CC=CC=C3)O)C4=CC=CC=C4
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Product OPENEYE NAME: N-[4-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenyl]acetamide
CAS Name: N-[4-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenyl]acetamide
IUPAC NAME: N-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
SYSTEMATIC NAME: N-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]ethanamide
MOLECULAR FORMULA: C17H20N4O3S
MOLECULAR WEIGHT: 360.4307
SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3
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Product OPENEYE NAME: (2S)-N-benzhydryl-2-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
CAS Name: (2S)-N-(diphenylmethyl)-2-[[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]thio]propanamide
IUPAC NAME: (2S)-N-benzhydryl-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
SYSTEMATIC NAME: (2S)-N-(diphenylmethyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C22H19N3O3S
MOLECULAR WEIGHT: 405.46956
SMILES: C[C@@H](C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NN=C(O3)C4=CC=CO4
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Product OPENEYE NAME: (2R)-N-benzhydryl-2-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
CAS Name: (2R)-N-(diphenylmethyl)-2-[[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]thio]propanamide
IUPAC NAME: (2R)-N-benzhydryl-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
SYSTEMATIC NAME: (2R)-N-(diphenylmethyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C22H19N3O3S
MOLECULAR WEIGHT: 405.46956
SMILES: C[C@H](C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NN=C(O3)C4=CC=CO4
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Product OPENEYE NAME: N-[(5-benzoyl-2-hydroxy-phenyl)methyl]-2-chloro-acetamide
CAS Name: N-[(5-benzoyl-2-hydroxyphenyl)methyl]-2-chloroacetamide
IUPAC NAME: N-[(5-benzoyl-2-hydroxyphenyl)methyl]-2-chloroacetamide
SYSTEMATIC NAME: 2-chloranyl-N-[[2-oxidanyl-5-(phenylcarbonyl)phenyl]methyl]ethanamide
MOLECULAR FORMULA: C16H14ClNO3
MOLECULAR WEIGHT: 303.74026
SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)O)CNC(=O)CCl
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Product OPENEYE NAME: 2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(2-morpholino-2-oxo-ethoxy)phenyl]benzamide
CAS Name: 2-[(4-fluorophenyl)methylthio]-N-[4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]benzamide
IUPAC NAME: 2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]benzamide
SYSTEMATIC NAME: 2-[(4-fluorophenyl)methylsulfanyl]-N-[4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]benzamide
MOLECULAR FORMULA: C26H25FN2O4S
MOLECULAR WEIGHT: 480.551103
SMILES: C1COCCN1C(=O)COC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)F
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Product OPENEYE NAME: [5-(indoline-1-carbonyl)-2-thienyl]-indolin-1-yl-methanone
CAS Name: 2,3-dihydroindol-1-yl-[5-[2,3-dihydroindol-1-yl(oxo)methyl]-2-thiophenyl]methanone
IUPAC NAME: [5-(2,3-dihydroindole-1-carbonyl)thiophen-2-yl]-(2,3-dihydroindol-1-yl)methanone
SYSTEMATIC NAME: 2,3-dihydroindol-1-yl-[5-(2,3-dihydroindol-1-ylcarbonyl)thiophen-2-yl]methanone
MOLECULAR FORMULA: C22H18N2O2S
MOLECULAR WEIGHT: 374.45552
SMILES: C1CN(C2=CC=CC=C21)C(=O)C3=CC=C(S3)C(=O)N4CCC5=CC=CC=C54
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Product OPENEYE NAME: N-[4-[(2S)-3-cyclohexyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
CAS Name: N-[4-[(2S)-3-cyclohexyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
IUPAC NAME: N-[4-[(2S)-3-cyclohexyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[(2S)-3-cyclohexyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenyl]ethanamide
MOLECULAR FORMULA: C22H25N3O2
MOLECULAR WEIGHT: 363.4528
SMILES: CC(=O)NC1=CC=C(C=C1)[C@H]2NC3=CC=CC=C3C(=O)N2C4CCCCC4
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Product OPENEYE NAME: N-[4-[(2R)-3-cyclohexyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
CAS Name: N-[4-[(2R)-3-cyclohexyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
IUPAC NAME: N-[4-[(2R)-3-cyclohexyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[(2R)-3-cyclohexyl-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenyl]ethanamide
MOLECULAR FORMULA: C22H25N3O2
MOLECULAR WEIGHT: 363.4528
SMILES: CC(=O)NC1=CC=C(C=C1)[C@@H]2NC3=CC=CC=C3C(=O)N2C4CCCCC4
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Product OPENEYE NAME: (2S)-N-(2-furylmethyl)-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2S)-N-(2-furanylmethyl)-1-(2-naphthalenylsulfonyl)-2-pyrrolidinecarboxamide
IUPAC NAME: (2S)-N-(furan-2-ylmethyl)-1-naphthalen-2-ylsulfonylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-N-(furan-2-ylmethyl)-1-naphthalen-2-ylsulfonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C20H20N2O4S
MOLECULAR WEIGHT: 384.4488
SMILES: C1C[C@H](N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NCC4=CC=CO4
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Product OPENEYE NAME: (2R)-N-(2-furylmethyl)-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: (2R)-N-(2-furanylmethyl)-1-(2-naphthalenylsulfonyl)-2-pyrrolidinecarboxamide
IUPAC NAME: (2R)-N-(furan-2-ylmethyl)-1-naphthalen-2-ylsulfonylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2R)-N-(furan-2-ylmethyl)-1-naphthalen-2-ylsulfonyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C20H20N2O4S
MOLECULAR WEIGHT: 384.4488
SMILES: C1C[C@@H](N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NCC4=CC=CO4
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Product OPENEYE NAME: 4-fluoro-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzenesulfonamide
CAS Name: 4-fluoro-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)benzenesulfonamide
IUPAC NAME: 4-fluoro-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-fluoranyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzenesulfonamide
MOLECULAR FORMULA: C18H18FNO4S
MOLECULAR WEIGHT: 363.403223
SMILES: C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 4-fluoro-N-[2-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]benzenesulfonamide
CAS Name: 4-fluoro-N-[2-[[(2S)-2-methyl-1-piperidinyl]-oxomethyl]phenyl]benzenesulfonamide
IUPAC NAME: 4-fluoro-N-[2-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]benzenesulfonamide
SYSTEMATIC NAME: 4-fluoranyl-N-[2-[(2S)-2-methylpiperidin-1-yl]carbonylphenyl]benzenesulfonamide
MOLECULAR FORMULA: C19H21FN2O3S
MOLECULAR WEIGHT: 376.445043
SMILES: C[C@H]1CCCCN1C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 4-fluoro-N-[2-[(2R)-2-methylpiperidine-1-carbonyl]phenyl]benzenesulfonamide
CAS Name: 4-fluoro-N-[2-[[(2R)-2-methyl-1-piperidinyl]-oxomethyl]phenyl]benzenesulfonamide
IUPAC NAME: 4-fluoro-N-[2-[(2R)-2-methylpiperidine-1-carbonyl]phenyl]benzenesulfonamide
SYSTEMATIC NAME: 4-fluoranyl-N-[2-[(2R)-2-methylpiperidin-1-yl]carbonylphenyl]benzenesulfonamide
MOLECULAR FORMULA: C19H21FN2O3S
MOLECULAR WEIGHT: 376.445043
SMILES: C[C@@H]1CCCCN1C(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-methoxy-4-methylsulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide
CAS Name: 2-methoxy-4-(methylthio)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)benzamide
IUPAC NAME: 2-methoxy-4-methylsulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylbenzamide
SYSTEMATIC NAME: 2-methoxy-4-methylsulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-benzamide
MOLECULAR FORMULA: C21H23NO4S
MOLECULAR WEIGHT: 385.47662
SMILES: COC1=C(C=CC(=C1)SC)C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4
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Product OPENEYE NAME: N,N-diethyl-5-methyl-4-oxo-3-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxamide
CAS Name: N,N-diethyl-5-methyl-4-oxo-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxamide
IUPAC NAME: N,N-diethyl-5-methyl-4-oxo-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxamide
SYSTEMATIC NAME: N,N-diethyl-5-methyl-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C18H19N3O2S2
MOLECULAR WEIGHT: 373.49236
SMILES: CCN(CC)C(=O)C1=C(C2=C(S1)NC(=S)N(C2=O)C3=CC=CC=C3)C
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Product OPENEYE NAME: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide
CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-N-[2-(1-cyclohexenyl)ethyl]acetamide
IUPAC NAME: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide
SYSTEMATIC NAME: 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]ethanamide
MOLECULAR FORMULA: C27H29ClN2O3
MOLECULAR WEIGHT: 464.98376
SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCC4=CCCCC4
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