Saturday, February 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: tert-butyl-(2,4-dibromophenoxy)-(9-ethylcarbazol-3-yl)-(2-methyl-5-nitro-phenyl)imino-$l^{5}-phosphane
CAS Name: tert-butyl-(2,4-dibromophenoxy)-(9-ethyl-3-carbazolyl)-(2-methyl-5-nitrophenyl)iminophosphorane
IUPAC NAME: tert-butyl-(2,4-dibromophenoxy)-(9-ethylcarbazol-3-yl)-(2-methyl-5-nitrophenyl)imino-$l^{5}-phosphane
SYSTEMATIC NAME: [2,4-bis(bromanyl)phenoxy]-tert-butyl-(9-ethylcarbazol-3-yl)-(2-methyl-5-nitro-phenyl)imino-$l^{5}-phosphane
MOLECULAR FORMULA: C31H30Br2N3O3P
MOLECULAR WEIGHT: 683.369961
SMILES: CCN1C2=C(C=C(C=C2)P(=NC3=C(C=CC(=C3)[N+](=O)[O-])C)(C(C)(C)C)OC4=C(C=C(C=C4)Br)Br)C5=CC=CC=C51
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Product OPENEYE NAME: 2-[(3-chlorophenyl)methylamino]-N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]acetamide
CAS Name: 2-[(3-chlorophenyl)methylamino]-N-[2-(diethylamino)-5-(4-morpholinylsulfonyl)phenyl]acetamide
IUPAC NAME: 2-[(3-chlorophenyl)methylamino]-N-[2-(diethylamino)-5-morpholin-4-ylsulfonylphenyl]acetamide
SYSTEMATIC NAME: 2-[(3-chlorophenyl)methylamino]-N-[2-(diethylamino)-5-morpholin-4-ylsulfonyl-phenyl]ethanamide
MOLECULAR FORMULA: C23H31ClN4O4S
MOLECULAR WEIGHT: 495.03464
SMILES: CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CNCC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: [2-(2-methyl-5-morpholinosulfonyl-anilino)-2-oxo-ethyl] 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate
CAS Name: 3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxylic acid [2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester
IUPAC NAME: [2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxylate
SYSTEMATIC NAME: [2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate
MOLECULAR FORMULA: C26H26N4O6S2
MOLECULAR WEIGHT: 554.63784
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)COC(=O)C3=CC4=C(S3)N(N=C4C)C5=CC=CC=C5
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Product OPENEYE NAME: [2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl] 3-methoxybenzoate
CAS Name: 3-methoxybenzoic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester
IUPAC NAME: [2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 3-methoxybenzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 3-methoxybenzoate
MOLECULAR FORMULA: C15H19NO5
MOLECULAR WEIGHT: 293.31506
SMILES: COC1=CC=CC(=C1)C(=O)OCC(=O)NCC2CCCO2
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Product OPENEYE NAME: 1-[3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(1-methyltetrazol-5-yl)sulfanyl-ethanone
CAS Name: 1-[3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-[(1-methyl-5-tetrazolyl)thio]ethanone
IUPAC NAME: 1-[3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(1-methyltetrazol-5-yl)sulfanylethanone
SYSTEMATIC NAME: 1-[3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone
MOLECULAR FORMULA: C24H22Cl2N6OS
MOLECULAR WEIGHT: 513.44208
SMILES: CN1C(=NN=N1)SCC(=O)N2C(C3CCCC(=CC4=CC=C(C=C4)Cl)C3=N2)C5=CC=C(C=C5)Cl
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Product OPENEYE NAME: N-[(4-butoxyphenyl)methyleneamino]-2-chloro-5-(trifluoromethyl)aniline
CAS Name: N-[(4-butoxyphenyl)methylideneamino]-2-chloro-5-(trifluoromethyl)aniline
IUPAC NAME: N-[(4-butoxyphenyl)methylideneamino]-2-chloro-5-(trifluoromethyl)aniline
SYSTEMATIC NAME: N-[(4-butoxyphenyl)methylideneamino]-2-chloranyl-5-(trifluoromethyl)aniline
MOLECULAR FORMULA: C18H18ClF3N2O
MOLECULAR WEIGHT: 370.79653
SMILES: CCCCOC1=CC=C(C=C1)C=NNC2=C(C=CC(=C2)C(F)(F)F)Cl
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Product OPENEYE NAME: 1-(3-morpholinopropyl)-3-(4-nitrophenyl)urea
CAS Name: 1-[3-(4-morpholinyl)propyl]-3-(4-nitrophenyl)urea
IUPAC NAME: 1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)urea
SYSTEMATIC NAME: 1-(3-morpholin-4-ylpropyl)-3-(4-nitrophenyl)urea
MOLECULAR FORMULA: C14H20N4O4
MOLECULAR WEIGHT: 308.333
SMILES: C1COCCN1CCCNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl 2-[2-[4-[ethyl(phenyl)sulfamoyl]benzoyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[2-[[4-[ethyl(phenyl)sulfamoyl]phenyl]-oxomethyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[2-[4-[ethyl(phenyl)sulfamoyl]benzoyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: ethyl 2-[2-[4-[ethyl(phenyl)sulfamoyl]phenyl]carbonylimino-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C27H27N3O7S3
MOLECULAR WEIGHT: 601.71418
SMILES: CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)CC(=O)OCC
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Product OPENEYE NAME: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]tetralin-6-carboxamide
CAS Name: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
IUPAC NAME: N-[4,6-difluoro-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SYSTEMATIC NAME: N-[4,6-bis(fluoranyl)-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
MOLECULAR FORMULA: C21H20F2N2O2S
MOLECULAR WEIGHT: 402.457506
SMILES: COCCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=C(CCCC4)C=C3)F)F
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Product OPENEYE NAME: ethyl 2-[2-(3,4-dimethoxybenzoyl)imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetate
CAS Name: 2-[2-[(3,4-dimethoxyphenyl)-oxomethyl]imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[2-(3,4-dimethoxybenzoyl)imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetate
SYSTEMATIC NAME: ethyl 2-[2-(3,4-dimethoxyphenyl)carbonylimino-4,6-bis(fluoranyl)-1,3-benzothiazol-3-yl]ethanoate
MOLECULAR FORMULA: C20H18F2N2O5S
MOLECULAR WEIGHT: 436.429126
SMILES: CCOC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=C(C=C3)OC)OC)F)F
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Product OPENEYE NAME: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide
CAS Name: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide
IUPAC NAME: N-(4-fluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide
SYSTEMATIC NAME: N-(4-fluoranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide
MOLECULAR FORMULA: C17H9FN4O5S
MOLECULAR WEIGHT: 400.340563
SMILES: C#CCN1C2=C(C=CC=C2SC1=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])F
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