Wednesday, October 31, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)acetamide
CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)acetamide
IUPAC NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)acetamide
SYSTEMATIC NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)ethanamide
MOLECULAR FORMULA: C13H12FN3OS
MOLECULAR WEIGHT: 277.317283
SMILES: C1CC1C2=NN=C(S2)NC(=O)CC3=CC=CC=C3F
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Product OPENEYE NAME: N'-(2,5-dichlorophenyl)-2,4-difluoro-benzohydrazide
CAS Name: N'-(2,5-dichlorophenyl)-2,4-difluorobenzohydrazide
IUPAC NAME: N'-(2,5-dichlorophenyl)-2,4-difluorobenzohydrazide
SYSTEMATIC NAME: N'-[2,5-bis(chloranyl)phenyl]-2,4-bis(fluoranyl)benzohydrazide
MOLECULAR FORMULA: C13H8Cl2F2N2O
MOLECULAR WEIGHT: 317.118226
SMILES: C1=CC(=C(C=C1F)F)C(=O)NNC2=C(C=CC(=C2)Cl)Cl
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Product OPENEYE NAME: 4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
CAS Name: 4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
IUPAC NAME: 4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
SYSTEMATIC NAME: 4-chloranyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]benzenesulfonamide
MOLECULAR FORMULA: C13H8Cl2F3NO2S
MOLECULAR WEIGHT: 370.17433
SMILES: C1=CC(=CC=C1S(=O)(=O)NC2=C(C=C(C=C2)C(F)(F)F)Cl)Cl
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Product OPENEYE NAME: 4-bromo-5-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CAS Name: 4-bromo-5-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]-2-thiophenesulfonamide
IUPAC NAME: 4-bromo-5-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 4-bromanyl-5-chloranyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C11H5BrCl2F3NO2S2
MOLECULAR WEIGHT: 455.09811
SMILES: C1=CC(=C(C=C1C(F)(F)F)Cl)NS(=O)(=O)C2=CC(=C(S2)Cl)Br
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Product OPENEYE NAME: 5-bromo-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CAS Name: 5-bromo-N-[2-chloro-4-(trifluoromethyl)phenyl]-2-thiophenesulfonamide
IUPAC NAME: 5-bromo-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 5-bromanyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C11H6BrClF3NO2S2
MOLECULAR WEIGHT: 420.65305
SMILES: C1=CC(=C(C=C1C(F)(F)F)Cl)NS(=O)(=O)C2=CC=C(S2)Br
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Product OPENEYE NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-4-fluoro-benzamide
CAS Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-4-fluorobenzamide
IUPAC NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-4-fluorobenzamide
SYSTEMATIC NAME: N-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-fluoranyl-benzamide
MOLECULAR FORMULA: C14H8ClF4NO
MOLECULAR WEIGHT: 317.666033
SMILES: C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)C(F)(F)F)Cl)F
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Product OPENEYE NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide
CAS Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide
IUPAC NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: N-[2-chloranyl-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C18H12ClF3N2O2
MOLECULAR WEIGHT: 380.74829
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)C(F)(F)F)Cl
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Product OPENEYE NAME: ethyl 4-morpholino-3-[(4-pentylphenyl)sulfonylamino]benzoate
CAS Name: 4-(4-morpholinyl)-3-[(4-pentylphenyl)sulfonylamino]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-morpholin-4-yl-3-[(4-pentylphenyl)sulfonylamino]benzoate
SYSTEMATIC NAME: ethyl 4-morpholin-4-yl-3-[(4-pentylphenyl)sulfonylamino]benzoate
MOLECULAR FORMULA: C24H32N2O5S
MOLECULAR WEIGHT: 460.58628
SMILES: CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCOCC3
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Product OPENEYE NAME: ethyl 3-[(4-bromo-5-chloro-2-thienyl)sulfonylamino]-4-morpholino-benzoate
CAS Name: 3-[(4-bromo-5-chloro-2-thiophenyl)sulfonylamino]-4-(4-morpholinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 3-[(4-bromo-5-chlorothiophen-2-yl)sulfonylamino]-4-morpholin-4-ylbenzoate
SYSTEMATIC NAME: ethyl 3-[(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-4-morpholin-4-yl-benzoate
MOLECULAR FORMULA: C17H18BrClN2O5S2
MOLECULAR WEIGHT: 509.82222
SMILES: CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NS(=O)(=O)C3=CC(=C(S3)Cl)Br
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Product OPENEYE NAME: methyl 3-[(4-chlorophenyl)methoxy]thiophene-2-carboxylate
CAS Name: 3-[(4-chlorophenyl)methoxy]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[(4-chlorophenyl)methoxy]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[(4-chlorophenyl)methoxy]thiophene-2-carboxylate
MOLECULAR FORMULA: C13H11ClO3S
MOLECULAR WEIGHT: 282.74264
SMILES: COC(=O)C1=C(C=CS1)OCC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-(4-benzyloxyphenyl)-3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]urea
CAS Name: 1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-3-(4-phenylmethoxyphenyl)urea
IUPAC NAME: 1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-3-(4-phenylmethoxyphenyl)urea
SYSTEMATIC NAME: 1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-3-(4-phenylmethoxyphenyl)urea
MOLECULAR FORMULA: C24H29N3O3S
MOLECULAR WEIGHT: 439.57036
SMILES: CN(C)CC1=CC=C(O1)CSCCNC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: ethyl 4-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 4-(5-chloro-1,3-dimethyl-4-pyrazolyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(5-chloro-1,3-dimethylpyrazol-4-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C13H17ClN4O3
MOLECULAR WEIGHT: 312.75208
SMILES: CCOC(=O)C1=C(NC(=O)NC1C2=C(N(N=C2C)C)Cl)C
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Product OPENEYE NAME: ethyl 6-methyl-2-oxo-4-[5-(2-phenylethynyl)-2-thienyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 6-methyl-2-oxo-4-[5-(2-phenylethynyl)-2-thiophenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-methyl-2-oxo-4-[5-(2-phenylethynyl)thiophen-2-yl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 6-methyl-2-oxidanylidene-4-[5-(2-phenylethynyl)thiophen-2-yl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C20H18N2O3S
MOLECULAR WEIGHT: 366.43352
SMILES: CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(S2)C#CC3=CC=CC=C3)C
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Product OPENEYE NAME: ethyl 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C20H24N2O3
MOLECULAR WEIGHT: 340.41616
SMILES: CCCCC#CC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC
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Product OPENEYE NAME: 4-benzyl-N-(2,4-difluorophenyl)piperazine-1-carboxamide
CAS Name: N-(2,4-difluorophenyl)-4-(phenylmethyl)-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-(2,4-difluorophenyl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]-4-(phenylmethyl)piperazine-1-carboxamide
MOLECULAR FORMULA: C18H19F2N3O
MOLECULAR WEIGHT: 331.359766
SMILES: C1CN(CCN1CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)F)F
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Product OPENEYE NAME: 4-benzyl-N-(5-chloro-2-methoxy-phenyl)piperazine-1-carboxamide
CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(phenylmethyl)-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-(5-chloro-2-methoxyphenyl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-(5-chloranyl-2-methoxy-phenyl)-4-(phenylmethyl)piperazine-1-carboxamide
MOLECULAR FORMULA: C19H22ClN3O2
MOLECULAR WEIGHT: 359.84988
SMILES: COC1=C(C=C(C=C1)Cl)NC(=O)N2CCN(CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
CAS Name: 4-(phenylmethyl)-N-[4-(trifluoromethoxy)phenyl]-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
SYSTEMATIC NAME: 4-(phenylmethyl)-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide
MOLECULAR FORMULA: C19H20F3N3O2
MOLECULAR WEIGHT: 379.37621
SMILES: C1CN(CCN1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 4-benzyl-N-(3,5-dimethylisoxazol-4-yl)piperazine-1-carboxamide
CAS Name: N-(3,5-dimethyl-4-isoxazolyl)-4-(phenylmethyl)-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-(3,5-dimethyl-1,2-oxazol-4-yl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(phenylmethyl)piperazine-1-carboxamide
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: CC1=C(C(=NO1)C)NC(=O)N2CCN(CC2)CC3=CC=CC=C3
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