Saturday, December 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(1-phenylethoxy)propyl]thiophene-2-carboxamide
CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(1-phenylethoxy)propyl]-2-thiophenecarboxamide
IUPAC NAME: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(1-phenylethoxy)propyl]thiophene-2-carboxamide
SYSTEMATIC NAME: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[3-(1-phenylethoxy)propyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C25H28N2O4S2
MOLECULAR WEIGHT: 484.63082
SMILES: CC(C1=CC=CC=C1)OCCCNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3
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Product OPENEYE NAME: 2-ethylsulfonyl-N-[3-(1-phenylethoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name: 2-ethylsulfonyl-N-[3-(1-phenylethoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC NAME: 2-ethylsulfonyl-N-[3-(1-phenylethoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
SYSTEMATIC NAME: 2-ethylsulfonyl-N-[3-(1-phenylethoxy)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
MOLECULAR FORMULA: C23H30N2O4S
MOLECULAR WEIGHT: 430.5603
SMILES: CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NCCCOC(C)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(8-tert-butyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[3-(1-phenylethoxy)propyl]acetamide
CAS Name: 2-(8-tert-butyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[3-(1-phenylethoxy)propyl]acetamide
IUPAC NAME: 2-(8-tert-butyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)-N-[3-(1-phenylethoxy)propyl]acetamide
SYSTEMATIC NAME: 2-[8-tert-butyl-1,3-bis(oxidanylidene)-2,4-diazaspiro[4.5]decan-2-yl]-N-[3-(1-phenylethoxy)propyl]ethanamide
MOLECULAR FORMULA: C25H37N3O4
MOLECULAR WEIGHT: 443.57898
SMILES: CC(C1=CC=CC=C1)OCCCNC(=O)CN2C(=O)C3(CCC(CC3)C(C)(C)C)NC2=O
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Product OPENEYE NAME: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)-3-piperidyl]methanone
CAS Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methanone
IUPAC NAME: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)piperidin-3-yl]methanone
SYSTEMATIC NAME: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-thiophen-2-ylcarbonylpiperidin-3-yl)methanone
MOLECULAR FORMULA: C24H28N2O4S
MOLECULAR WEIGHT: 440.55512
SMILES: C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5
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Product OPENEYE NAME: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)-3-piperidyl]methanone
CAS Name: [2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methanone
IUPAC NAME: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)piperidin-3-yl]methanone
SYSTEMATIC NAME: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-(1-thiophen-2-ylcarbonylpiperidin-3-yl)methanone
MOLECULAR FORMULA: C23H28N2O4S
MOLECULAR WEIGHT: 428.54442
SMILES: COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3CCCN(C3)C(=O)C4=CC=CS4
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Product OPENEYE NAME: [2-(3-methoxyphenyl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)-3-piperidyl]methanone
CAS Name: [2-(3-methoxyphenyl)-1-pyrrolidinyl]-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methanone
IUPAC NAME: [2-(3-methoxyphenyl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)piperidin-3-yl]methanone
SYSTEMATIC NAME: [2-(3-methoxyphenyl)pyrrolidin-1-yl]-(1-thiophen-2-ylcarbonylpiperidin-3-yl)methanone
MOLECULAR FORMULA: C22H26N2O3S
MOLECULAR WEIGHT: 398.51844
SMILES: COC1=CC=CC(=C1)C2CCCN2C(=O)C3CCCN(C3)C(=O)C4=CC=CS4
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Product OPENEYE NAME: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-1-(3-isopropylphenyl)-5-oxo-pyrrolidine-3-carboxamide
CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-5-oxo-1-(3-propan-2-ylphenyl)-3-pyrrolidinecarboxamide
IUPAC NAME: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-5-oxo-1-(3-propan-2-ylphenyl)pyrrolidine-3-carboxamide
SYSTEMATIC NAME: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-5-oxidanylidene-1-(3-propan-2-ylphenyl)pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C25H31ClN4O2
MOLECULAR WEIGHT: 454.99224
SMILES: CC(C)C1=CC(=CC=C1)N2CC(CC2=O)C(=O)NC3=C(C=CC(=C3)Cl)N4CCN(CC4)C
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Product OPENEYE NAME: (2,4-dimethylphenyl) 1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate
CAS Name: 1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (2,4-dimethylphenyl) ester
IUPAC NAME: (2,4-dimethylphenyl) 1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate
SYSTEMATIC NAME: (2,4-dimethylphenyl) 1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: CC1=CC(=C(C=C1)OC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)OC)C
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Product OPENEYE NAME: methyl 3-(2-thienyl)-3-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]propanoate
CAS Name: 3-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester
IUPAC NAME: methyl 3-[[1-(thiophene-2-carbonyl)piperidine-3-carbonyl]amino]-3-thiophen-2-ylpropanoate
SYSTEMATIC NAME: methyl 3-thiophen-2-yl-3-[(1-thiophen-2-ylcarbonylpiperidin-3-yl)carbonylamino]propanoate
MOLECULAR FORMULA: C19H22N2O4S2
MOLECULAR WEIGHT: 406.51898
SMILES: COC(=O)CC(C1=CC=CS1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3
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Product OPENEYE NAME: N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide
CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazinyl)phenyl]-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: N-[5-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: N-[5-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C24H29ClN4O3
MOLECULAR WEIGHT: 456.96506
SMILES: CCN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)OC
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Product OPENEYE NAME: N-[2-(3-pyridyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[2-(3-pyridinyl)ethyl]-3-piperidinecarboxamide
IUPAC NAME: N-(2-pyridin-3-ylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SYSTEMATIC NAME: N-(2-pyridin-3-ylethyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide
MOLECULAR FORMULA: C18H21N3O2S
MOLECULAR WEIGHT: 343.44324
SMILES: C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCCC3=CN=CC=C3
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Product OPENEYE NAME: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate
CAS Name: 1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester
IUPAC NAME: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate
SYSTEMATIC NAME: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate
MOLECULAR FORMULA: C21H20ClNO6
MOLECULAR WEIGHT: 417.8396
SMILES: COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)OCC3=CC4=C(C(=C3)Cl)OCCO4
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Product OPENEYE NAME: N-(1-ethylpropyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
CAS Name: 1-[3-furanyl(oxo)methyl]-N-pentan-3-yl-3-piperidinecarboxamide
IUPAC NAME: 1-(furan-3-carbonyl)-N-pentan-3-ylpiperidine-3-carboxamide
SYSTEMATIC NAME: 1-(furan-3-ylcarbonyl)-N-pentan-3-yl-piperidine-3-carboxamide
MOLECULAR FORMULA: C16H24N2O3
MOLECULAR WEIGHT: 292.37336
SMILES: CCC(CC)NC(=O)C1CCCN(C1)C(=O)C2=COC=C2
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Product OPENEYE NAME: N-[1-(2-fluorophenyl)ethyl]-1-(furan-3-carbonyl)piperidine-3-carboxamide
CAS Name: N-[1-(2-fluorophenyl)ethyl]-1-[3-furanyl(oxo)methyl]-3-piperidinecarboxamide
IUPAC NAME: N-[1-(2-fluorophenyl)ethyl]-1-(furan-3-carbonyl)piperidine-3-carboxamide
SYSTEMATIC NAME: N-[1-(2-fluorophenyl)ethyl]-1-(furan-3-ylcarbonyl)piperidine-3-carboxamide
MOLECULAR FORMULA: C19H21FN2O3
MOLECULAR WEIGHT: 344.380043
SMILES: CC(C1=CC=CC=C1F)NC(=O)C2CCCN(C2)C(=O)C3=COC=C3
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