Sunday, December 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-(2-bromophenyl)-5-[[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]methyl]-1,3,4-oxadiazole
CAS Name: 2-(2-bromophenyl)-5-[[4-[1-(2-chlorophenyl)ethyl]-1-piperazinyl]methyl]-1,3,4-oxadiazole
IUPAC NAME: 2-(2-bromophenyl)-5-[[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]methyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-(2-bromophenyl)-5-[[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]methyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C21H22BrClN4O
MOLECULAR WEIGHT: 461.78258
SMILES: CC(C1=CC=CC=C1Cl)N2CCN(CC2)CC3=NN=C(O3)C4=CC=CC=C4Br
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Product OPENEYE NAME: N-(1-cyanocyclohexyl)-2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]propanamide
CAS Name: N-(1-cyanocyclohexyl)-2-[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazinyl]propanamide
IUPAC NAME: N-(1-cyanocyclohexyl)-2-[4-(2-methyl-2-phenylpropanoyl)piperazin-1-yl]propanamide
SYSTEMATIC NAME: N-(1-cyanocyclohexyl)-2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]propanamide
MOLECULAR FORMULA: C24H34N4O2
MOLECULAR WEIGHT: 410.55236
SMILES: CC(C(=O)NC1(CCCCC1)C#N)N2CCN(CC2)C(=O)C(C)(C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl 3-bromo-4-(2,4-difluorophenoxy)sulfonyl-benzoate
CAS Name: 3-bromo-4-(2,4-difluorophenoxy)sulfonylbenzoic acid ethyl ester
IUPAC NAME: ethyl 3-bromo-4-(2,4-difluorophenoxy)sulfonylbenzoate
SYSTEMATIC NAME: ethyl 4-[2,4-bis(fluoranyl)phenoxy]sulfonyl-3-bromanyl-benzoate
MOLECULAR FORMULA: C15H11BrF2O5S
MOLECULAR WEIGHT: 421.210646
SMILES: CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)F)F)Br
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Product OPENEYE NAME: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[1-(2-fluorophenyl)ethyl]propanamide
CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[1-(2-fluorophenyl)ethyl]propanamide
IUPAC NAME: 3-(2-amino-2-oxoethyl)sulfanyl-N-[1-(2-fluorophenyl)ethyl]propanamide
SYSTEMATIC NAME: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[1-(2-fluorophenyl)ethyl]propanamide
MOLECULAR FORMULA: C13H17FN2O2S
MOLECULAR WEIGHT: 284.349683
SMILES: CC(C1=CC=CC=C1F)NC(=O)CCSCC(=O)N
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Product OPENEYE NAME: 2-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]sulfanylacetamide
CAS Name: 2-[[3-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]thio]acetamide
IUPAC NAME: 2-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]sulfanylacetamide
SYSTEMATIC NAME: 2-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]sulfanylethanamide
MOLECULAR FORMULA: C17H24N2O4S
MOLECULAR WEIGHT: 352.44846
SMILES: COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CCSCC(=O)N
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Product OPENEYE NAME: 1-(4-fluoro-3-nitro-phenyl)-N-[(4-fluorophenyl)-(2-thienyl)methyl]-5-oxo-pyrrolidine-3-carboxamide
CAS Name: 1-(4-fluoro-3-nitrophenyl)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-5-oxo-3-pyrrolidinecarboxamide
IUPAC NAME: 1-(4-fluoro-3-nitrophenyl)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-5-oxopyrrolidine-3-carboxamide
SYSTEMATIC NAME: 1-(4-fluoranyl-3-nitro-phenyl)-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C22H17F2N3O4S
MOLECULAR WEIGHT: 457.449886
SMILES: C1C(CN(C1=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])C(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4
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Product OPENEYE NAME: N-[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]chromane-3-carboxamide
CAS Name: N-[4-[oxo-(2,2,2-trifluoroethylamino)methyl]phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide
IUPAC NAME: N-[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
SYSTEMATIC NAME: N-[4-[2,2,2-tris(fluoranyl)ethylcarbamoyl]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
MOLECULAR FORMULA: C19H17F3N2O3
MOLECULAR WEIGHT: 378.34509
SMILES: C1C(COC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)C(=O)NCC(F)(F)F
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Product OPENEYE NAME: 4-bromo-3-nitro-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]benzamide
CAS Name: 4-bromo-3-nitro-N-[3-(2-oxolanylmethoxy)phenyl]benzamide
IUPAC NAME: 4-bromo-3-nitro-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide
SYSTEMATIC NAME: 4-bromanyl-3-nitro-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide
MOLECULAR FORMULA: C18H17BrN2O5
MOLECULAR WEIGHT: 421.24198
SMILES: C1CC(OC1)COC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]acetamide
CAS Name: 2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]-N-[3-(2-oxolanylmethoxy)phenyl]acetamide
IUPAC NAME: 2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
SYSTEMATIC NAME: 2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]-N-[3-(oxolan-2-ylmethoxy)phenyl]ethanamide
MOLECULAR FORMULA: C18H21ClN2O5S2
MOLECULAR WEIGHT: 444.95274
SMILES: CN(CC(=O)NC1=CC(=CC=C1)OCC2CCCO2)S(=O)(=O)C3=CC=C(S3)Cl
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Product OPENEYE NAME: N-(1-cyclopropylethyl)-3-(2,6-dichlorophenyl)-5-methyl-isoxazole-4-carboxamide
CAS Name: N-(1-cyclopropylethyl)-3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxamide
IUPAC NAME: N-(1-cyclopropylethyl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: 3-[2,6-bis(chloranyl)phenyl]-N-(1-cyclopropylethyl)-5-methyl-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C16H16Cl2N2O2
MOLECULAR WEIGHT: 339.21644
SMILES: CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC(C)C3CC3
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Product OPENEYE NAME: 1-(4-bromo-2-fluoro-benzoyl)-N-cyclopropyl-pyrrolidine-2-carboxamide
CAS Name: 1-[(4-bromo-2-fluorophenyl)-oxomethyl]-N-cyclopropyl-2-pyrrolidinecarboxamide
IUPAC NAME: 1-(4-bromo-2-fluorobenzoyl)-N-cyclopropylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: 1-(4-bromanyl-2-fluoranyl-phenyl)carbonyl-N-cyclopropyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C15H16BrFN2O2
MOLECULAR WEIGHT: 355.202143
SMILES: C1CC(N(C1)C(=O)C2=C(C=C(C=C2)Br)F)C(=O)NC3CC3
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Product OPENEYE NAME: [2-[2-(isobutylcarbamoyl)anilino]-2-oxo-ethyl] 2-ethylsulfinylbenzoate
CAS Name: 2-ethylsulfinylbenzoic acid [2-[2-[(2-methylpropylamino)-oxomethyl]anilino]-2-oxoethyl] ester
IUPAC NAME: [2-[2-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl] 2-ethylsulfinylbenzoate
SYSTEMATIC NAME: [2-[[2-(2-methylpropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-ethylsulfinylbenzoate
MOLECULAR FORMULA: C22H26N2O5S
MOLECULAR WEIGHT: 430.51724
SMILES: CCS(=O)C1=CC=CC=C1C(=O)OCC(=O)NC2=CC=CC=C2C(=O)NCC(C)C
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Product OPENEYE NAME: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-ethylsulfinylbenzoate
CAS Name: 2-ethylsulfinylbenzoic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester
IUPAC NAME: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-ethylsulfinylbenzoate
SYSTEMATIC NAME: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 2-ethylsulfinylbenzoate
MOLECULAR FORMULA: C15H19N5O3S
MOLECULAR WEIGHT: 349.40806
SMILES: CCS(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NC(=N2)N(C)C)N
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Product OPENEYE NAME: N-(1-cyclopropylethyl)-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
CAS Name: N-(1-cyclopropylethyl)-5-oxo-1-(3,4,5-trimethoxyphenyl)-3-pyrrolidinecarboxamide
IUPAC NAME: N-(1-cyclopropylethyl)-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
SYSTEMATIC NAME: N-(1-cyclopropylethyl)-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
MOLECULAR FORMULA: C19H26N2O5
MOLECULAR WEIGHT: 362.42014
SMILES: CC(C1CC1)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C(=C3)OC)OC)OC
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Product OPENEYE NAME: N-(1-cyclopropylethyl)-3-methoxy-4-(thiazol-4-ylmethoxy)benzamide
CAS Name: N-(1-cyclopropylethyl)-3-methoxy-4-(4-thiazolylmethoxy)benzamide
IUPAC NAME: N-(1-cyclopropylethyl)-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
SYSTEMATIC NAME: N-(1-cyclopropylethyl)-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
MOLECULAR FORMULA: C17H20N2O3S
MOLECULAR WEIGHT: 332.4173
SMILES: CC(C1CC1)NC(=O)C2=CC(=C(C=C2)OCC3=CSC=N3)OC
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Product OPENEYE NAME: 3-(cyclopentylsulfamoyl)-N-(1-cyclopropylethyl)benzamide
CAS Name: 3-(cyclopentylsulfamoyl)-N-(1-cyclopropylethyl)benzamide
IUPAC NAME: 3-(cyclopentylsulfamoyl)-N-(1-cyclopropylethyl)benzamide
SYSTEMATIC NAME: 3-(cyclopentylsulfamoyl)-N-(1-cyclopropylethyl)benzamide
MOLECULAR FORMULA: C17H24N2O3S
MOLECULAR WEIGHT: 336.44906
SMILES: CC(C1CC1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CCCC3
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