Monday, April 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: morpholino-[(3S)-1-(p-tolylsulfonyl)-3-piperidyl]methanone
CAS Name: [(3S)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]-(4-morpholinyl)methanone
IUPAC NAME: [(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]-morpholin-4-ylmethanone
SYSTEMATIC NAME: [(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]-morpholin-4-yl-methanone
MOLECULAR FORMULA: C17H24N2O4S
MOLECULAR WEIGHT: 352.44846
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N3CCOCC3
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Product OPENEYE NAME: [1-(2,5-dichlorophenyl)sulfonyl-4-piperidyl]-(4-ethylpiperazin-1-yl)methanone
CAS Name: [1-(2,5-dichlorophenyl)sulfonyl-4-piperidinyl]-(4-ethyl-1-piperazinyl)methanone
IUPAC NAME: [1-(2,5-dichlorophenyl)sulfonylpiperidin-4-yl]-(4-ethylpiperazin-1-yl)methanone
SYSTEMATIC NAME: [1-[2,5-bis(chloranyl)phenyl]sulfonylpiperidin-4-yl]-(4-ethylpiperazin-1-yl)methanone
MOLECULAR FORMULA: C18H25Cl2N3O3S
MOLECULAR WEIGHT: 434.3804
SMILES: CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl
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Product OPENEYE NAME: (4-ethylpiperazin-1-yl)-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]methanone
CAS Name: (4-ethyl-1-piperazinyl)-[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]methanone
IUPAC NAME: (4-ethylpiperazin-1-yl)-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone
SYSTEMATIC NAME: (4-ethylpiperazin-1-yl)-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methanone
MOLECULAR FORMULA: C18H26FN3O3S
MOLECULAR WEIGHT: 383.480743
SMILES: CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 3-[4-(isopropylsulfamoyl)phenyl]-N-(2-pyridylmethyl)propanamide
CAS Name: 3-[4-(propan-2-ylsulfamoyl)phenyl]-N-(2-pyridinylmethyl)propanamide
IUPAC NAME: 3-[4-(propan-2-ylsulfamoyl)phenyl]-N-(pyridin-2-ylmethyl)propanamide
SYSTEMATIC NAME: 3-[4-(propan-2-ylsulfamoyl)phenyl]-N-(pyridin-2-ylmethyl)propanamide
MOLECULAR FORMULA: C18H23N3O3S
MOLECULAR WEIGHT: 361.45852
SMILES: CC(C)NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)NCC2=CC=CC=N2
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Product OPENEYE NAME: methyl 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-chloro-phenoxy]acetate
CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-chlorophenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-chlorophenoxy]acetate
SYSTEMATIC NAME: methyl 2-[4-(1,3-benzodioxol-5-ylmethylsulfamoyl)-2-chloranyl-phenoxy]ethanoate
MOLECULAR FORMULA: C17H16ClNO7S
MOLECULAR WEIGHT: 413.82944
SMILES: COC(=O)COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)Cl
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-[[(1R)-1-methylpropyl]sulfamoyl]phenoxy]acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]acetamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]ethanamide
MOLECULAR FORMULA: C20H24N2O6S
MOLECULAR WEIGHT: 420.47936
SMILES: CC[C@@H](C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: 1-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide
CAS Name: 1-(4-chlorophenyl)sulfonyl-N-[2-(methylthio)phenyl]-4-piperidinecarboxamide
IUPAC NAME: 1-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide
SYSTEMATIC NAME: 1-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanylphenyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C19H21ClN2O3S2
MOLECULAR WEIGHT: 424.96464
SMILES: CSC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-isopropyl-4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide
CAS Name: 4-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-N-propan-2-ylbenzenesulfonamide
IUPAC NAME: 4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-N-propan-2-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-propan-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C23H31N3O4S
MOLECULAR WEIGHT: 445.57494
SMILES: CC(C)NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (4-ethylpiperazin-1-yl)-[(3S)-1-(p-tolylsulfonyl)-3-piperidyl]methanone
CAS Name: (4-ethyl-1-piperazinyl)-[(3S)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]methanone
IUPAC NAME: (4-ethylpiperazin-1-yl)-[(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone
SYSTEMATIC NAME: (4-ethylpiperazin-1-yl)-[(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone
MOLECULAR FORMULA: C19H29N3O3S
MOLECULAR WEIGHT: 379.51686
SMILES: CCN1CCN(CC1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: (4-ethylpiperazin-1-yl)-[(3R)-1-(p-tolylsulfonyl)-3-piperidyl]methanone
CAS Name: (4-ethyl-1-piperazinyl)-[(3R)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]methanone
IUPAC NAME: (4-ethylpiperazin-1-yl)-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone
SYSTEMATIC NAME: (4-ethylpiperazin-1-yl)-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone
MOLECULAR FORMULA: C19H29N3O3S
MOLECULAR WEIGHT: 379.51686
SMILES: CCN1CCN(CC1)C(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: ethyl 4-[3-chloro-4-(2-methoxy-2-oxo-ethoxy)phenyl]sulfonylpiperazine-1-carboxylate
CAS Name: 4-[3-chloro-4-(2-methoxy-2-oxoethoxy)phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[3-chloro-4-(2-methoxy-2-oxoethoxy)phenyl]sulfonylpiperazine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[3-chloranyl-4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]sulfonylpiperazine-1-carboxylate
MOLECULAR FORMULA: C16H21ClN2O7S
MOLECULAR WEIGHT: 420.86514
SMILES: CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)OC)Cl
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Product OPENEYE NAME: methyl 2-[2-chloro-4-[[(2R)-tetrahydrofuran-2-yl]methylsulfamoyl]phenoxy]acetate
CAS Name: 2-[2-chloro-4-[[(2R)-2-oxolanyl]methylsulfamoyl]phenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-chloro-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]phenoxy]acetate
SYSTEMATIC NAME: methyl 2-[2-chloranyl-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]phenoxy]ethanoate
MOLECULAR FORMULA: C14H18ClNO6S
MOLECULAR WEIGHT: 363.81382
SMILES: COC(=O)COC1=C(C=C(C=C1)S(=O)(=O)NC[C@H]2CCCO2)Cl
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Product OPENEYE NAME: methyl 2-[2-chloro-4-[[(2S)-tetrahydrofuran-2-yl]methylsulfamoyl]phenoxy]acetate
CAS Name: 2-[2-chloro-4-[[(2S)-2-oxolanyl]methylsulfamoyl]phenoxy]acetic acid methyl ester
IUPAC NAME: methyl 2-[2-chloro-4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenoxy]acetate
SYSTEMATIC NAME: methyl 2-[2-chloranyl-4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenoxy]ethanoate
MOLECULAR FORMULA: C14H18ClNO6S
MOLECULAR WEIGHT: 363.81382
SMILES: COC(=O)COC1=C(C=C(C=C1)S(=O)(=O)NC[C@@H]2CCCO2)Cl
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Product OPENEYE NAME: [(3S)-1-(4-chlorophenyl)sulfonyl-3-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CAS Name: [(3S)-1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
IUPAC NAME: [(3S)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
SYSTEMATIC NAME: [(3S)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
MOLECULAR FORMULA: C21H23ClN2O3S
MOLECULAR WEIGHT: 418.93692
SMILES: C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)N3CCC4=CC=CC=C4C3
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Product OPENEYE NAME: [(3R)-1-(4-chlorophenyl)sulfonyl-3-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CAS Name: [(3R)-1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
IUPAC NAME: [(3R)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
SYSTEMATIC NAME: [(3R)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
MOLECULAR FORMULA: C21H23ClN2O3S
MOLECULAR WEIGHT: 418.93692
SMILES: C1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)N3CCC4=CC=CC=C4C3
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Product OPENEYE NAME: N-[(1S)-1-methylbutyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide
CAS Name: 1-(4-methylphenyl)sulfonyl-N-[(2S)-pentan-2-yl]-4-piperidinecarboxamide
IUPAC NAME: 1-(4-methylphenyl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-(4-methylphenyl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide
MOLECULAR FORMULA: C18H28N2O3S
MOLECULAR WEIGHT: 352.49152
SMILES: CCC[C@H](C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C
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Product OPENEYE NAME: N-[(1R)-1-methylbutyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide
CAS Name: 1-(4-methylphenyl)sulfonyl-N-[(2R)-pentan-2-yl]-4-piperidinecarboxamide
IUPAC NAME: 1-(4-methylphenyl)sulfonyl-N-[(2R)-pentan-2-yl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-(4-methylphenyl)sulfonyl-N-[(2R)-pentan-2-yl]piperidine-4-carboxamide
MOLECULAR FORMULA: C18H28N2O3S
MOLECULAR WEIGHT: 352.49152
SMILES: CCC[C@@H](C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C
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Product OPENEYE NAME: (3S)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3S)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: (3S)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3S)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C20H21N3O4
MOLECULAR WEIGHT: 367.39844
SMILES: CNC(=O)C1=CC=CC=C1NC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (3R)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxo-pyrrolidine-3-carboxamide
CAS Name: (3R)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: (3R)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: (3R)-1-(4-methoxyphenyl)-N-[2-(methylcarbamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C20H21N3O4
MOLECULAR WEIGHT: 367.39844
SMILES: CNC(=O)C1=CC=CC=C1NC(=O)[C@@H]2CC(=O)N(C2)C3=CC=C(C=C3)OC
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