Wednesday, February 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-[2-methyl-N-(p-tolylsulfonyl)anilino]-N-(1-naphthyl)acetamide
CAS Name: 2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(1-naphthalenyl)acetamide
IUPAC NAME: 2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)-N-naphthalen-1-ylacetamide
SYSTEMATIC NAME: 2-[(2-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-naphthalen-1-yl-ethanamide
MOLECULAR FORMULA: C26H24N2O3S
MOLECULAR WEIGHT: 444.54536
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC=CC=C4C
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Product OPENEYE NAME: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-N-methylsulfonyl-anilino)acetamide
CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-N-methylsulfonylanilino)acetamide
IUPAC NAME: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-N-methylsulfonylanilino)acetamide
SYSTEMATIC NAME: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(3-methylphenyl)-methylsulfonyl-amino]ethanamide
MOLECULAR FORMULA: C20H26N2O5S
MOLECULAR WEIGHT: 406.49584
SMILES: CC1=CC(=CC=C1)N(CC(=O)NCCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C
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Product OPENEYE NAME: ethyl 5-amino-4-(4-fluoroanilino)-7-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate
CAS Name: 5-amino-4-(4-fluoroanilino)-7-methyl-2-(methylthio)-6-pyrrolo[2,3-d]pyrimidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-amino-4-(4-fluoroanilino)-7-methyl-2-methylsulfanylpyrrolo[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 5-azanyl-4-[(4-fluorophenyl)amino]-7-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C17H18FN5O2S
MOLECULAR WEIGHT: 375.420523
SMILES: CCOC(=O)C1=C(C2=C(N1C)N=C(N=C2NC3=CC=C(C=C3)F)SC)N
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Product OPENEYE NAME: N-(3-bromophenyl)-2-(3-chloro-4-methyl-phenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
CAS Name: N-(3-bromophenyl)-2-(3-chloro-4-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
IUPAC NAME: N-(3-bromophenyl)-2-(3-chloro-4-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
SYSTEMATIC NAME: N-(3-bromophenyl)-2-(3-chloranyl-4-methyl-phenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazinane-6-carboxamide
MOLECULAR FORMULA: C19H17BrClN3O2S
MOLECULAR WEIGHT: 466.77918
SMILES: CC1=C(C=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC(=CC=C3)Br)C)Cl
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Product OPENEYE NAME: N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]-3-phenyl-prop-2-enamide
CAS Name: N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]-3-phenyl-2-propenamide
IUPAC NAME: N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]-3-phenylprop-2-enamide
SYSTEMATIC NAME: N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]-3-phenyl-prop-2-enamide
MOLECULAR FORMULA: C22H15N3O4
MOLECULAR WEIGHT: 385.3722
SMILES: C1=CC=C(C=C1)C=CC(=O)NC2=CC=CC=C2C3=NC4=C(O3)C=CC(=C4)[N+](=O)[O-]
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Product OPENEYE NAME: N-(2-methoxyethyl)tetrahydrofuran-2-carboxamide
CAS Name: N-(2-methoxyethyl)-2-oxolanecarboxamide
IUPAC NAME: N-(2-methoxyethyl)oxolane-2-carboxamide
SYSTEMATIC NAME: N-(2-methoxyethyl)oxolane-2-carboxamide
MOLECULAR FORMULA: C8H15NO3
MOLECULAR WEIGHT: 173.2096
SMILES: COCCNC(=O)C1CCCO1
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Product OPENEYE NAME: N-[4-(diethylsulfamoyl)phenyl]-2,3-diphenyl-prop-2-enamide
CAS Name: N-[4-(diethylsulfamoyl)phenyl]-2,3-diphenyl-2-propenamide
IUPAC NAME: N-[4-(diethylsulfamoyl)phenyl]-2,3-diphenylprop-2-enamide
SYSTEMATIC NAME: N-[4-(diethylsulfamoyl)phenyl]-2,3-diphenyl-prop-2-enamide
MOLECULAR FORMULA: C25H26N2O3S
MOLECULAR WEIGHT: 434.55054
SMILES: CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 3-[(3,4-dichlorophenyl)methyl]-5-[[3-methoxy-4-[(3-nitro-2-pyridyl)oxy]phenyl]methylene]thiazolidine-2,4-dione
CAS Name: 3-[(3,4-dichlorophenyl)methyl]-5-[[3-methoxy-4-[(3-nitro-2-pyridinyl)oxy]phenyl]methylidene]thiazolidine-2,4-dione
IUPAC NAME: 3-[(3,4-dichlorophenyl)methyl]-5-[[3-methoxy-4-(3-nitropyridin-2-yl)oxyphenyl]methylidene]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 3-[(3,4-dichlorophenyl)methyl]-5-[[3-methoxy-4-(3-nitropyridin-2-yl)oxy-phenyl]methylidene]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C23H15Cl2N3O6S
MOLECULAR WEIGHT: 532.3527
SMILES: COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC(=C(C=C3)Cl)Cl)OC4=C(C=CC=N4)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(p-tolyl)-N-[3-(trifluoromethyl)phenyl]acetamide
CAS Name: 2-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: 2-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: 2-(4-methylphenyl)-N-[3-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C16H14F3NO
MOLECULAR WEIGHT: 293.28367
SMILES: CC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C(F)(F)F
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Product OPENEYE NAME: N-(2-ethylphenyl)-3-methyl-2-nitro-benzamide
CAS Name: N-(2-ethylphenyl)-3-methyl-2-nitrobenzamide
IUPAC NAME: N-(2-ethylphenyl)-3-methyl-2-nitrobenzamide
SYSTEMATIC NAME: N-(2-ethylphenyl)-3-methyl-2-nitro-benzamide
MOLECULAR FORMULA: C16H16N2O3
MOLECULAR WEIGHT: 284.30984
SMILES: CCC1=CC=CC=C1NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-]
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Product OPENEYE NAME: 2-chloroethyl N-(4-methoxyphenyl)carbamate
CAS Name: N-(4-methoxyphenyl)carbamic acid 2-chloroethyl ester
IUPAC NAME: 2-chloroethyl N-(4-methoxyphenyl)carbamate
SYSTEMATIC NAME: 2-chloroethyl N-(4-methoxyphenyl)carbamate
MOLECULAR FORMULA: C10H12ClNO3
MOLECULAR WEIGHT: 229.66018
SMILES: COC1=CC=C(C=C1)NC(=O)OCCCl
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Product OPENEYE NAME: ethyl 2-diethoxyphosphorylhexadecanoate
CAS Name: 2-diethoxyphosphorylhexadecanoic acid ethyl ester
IUPAC NAME: ethyl 2-diethoxyphosphorylhexadecanoate
SYSTEMATIC NAME: ethyl 2-diethoxyphosphorylhexadecanoate
MOLECULAR FORMULA: C22H45O5P
MOLECULAR WEIGHT: 420.563461
SMILES: CCCCCCCCCCCCCCC(C(=O)OCC)P(=O)(OCC)OCC
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Product OPENEYE NAME: 4-chloro-N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]benzamide
CAS Name: 4-chloro-N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]benzamide
IUPAC NAME: 4-chloro-N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]benzamide
SYSTEMATIC NAME: 4-chloranyl-N-[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]benzamide
MOLECULAR FORMULA: C20H12Cl2N2O2
MOLECULAR WEIGHT: 383.22748
SMILES: C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: N-butyl-N-ethyl-2-phenoxy-butanamide
CAS Name: N-butyl-N-ethyl-2-phenoxybutanamide
IUPAC NAME: N-butyl-N-ethyl-2-phenoxybutanamide
SYSTEMATIC NAME: N-butyl-N-ethyl-2-phenoxy-butanamide
MOLECULAR FORMULA: C16H25NO2
MOLECULAR WEIGHT: 263.3752
SMILES: CCCCN(CC)C(=O)C(CC)OC1=CC=CC=C1
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Product OPENEYE NAME: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2,2,2-trichloro-acetamide
CAS Name: 2,2,2-trichloro-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]acetamide
IUPAC NAME: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2,2,2-trichloroacetamide
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]ethanamide
MOLECULAR FORMULA: C11H8Cl3N3OS
MOLECULAR WEIGHT: 336.62472
SMILES: C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]thiazolidine-2,4-dione
CAS Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]thiazolidine-2,4-dione
IUPAC NAME: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 3-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C22H15ClINO6S
MOLECULAR WEIGHT: 583.78007
SMILES: COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC4=C(C=C3Cl)OCO4)I)OCC#C
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Product OPENEYE NAME: 3-cyclohexyl-N-(1-methylbutyl)propanamide
CAS Name: 3-cyclohexyl-N-pentan-2-ylpropanamide
IUPAC NAME: 3-cyclohexyl-N-pentan-2-ylpropanamide
SYSTEMATIC NAME: 3-cyclohexyl-N-pentan-2-yl-propanamide
MOLECULAR FORMULA: C14H27NO
MOLECULAR WEIGHT: 225.37028
SMILES: CCCC(C)NC(=O)CCC1CCCCC1
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Product OPENEYE NAME: (3-amino-4,6-dimethyl-thieno[2,3-b]pyridin-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone
CAS Name: (3-amino-4,6-dimethyl-2-thieno[2,3-b]pyridinyl)-(4-ethyl-1-piperazin-4-iumyl)methanone
IUPAC NAME: (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone
SYSTEMATIC NAME: (3-azanyl-4,6-dimethyl-thieno[2,3-b]pyridin-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone
MOLECULAR FORMULA: C16H23N4OS+
MOLECULAR WEIGHT: 319.44502
SMILES: CC[NH+]1CCN(CC1)C(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N
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