Saturday, April 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: ethyl (4R)-2-amino-7-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
CAS Name: (4R)-2-amino-7-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (4R)-2-amino-7-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
SYSTEMATIC NAME: ethyl (4R)-2-azanyl-7-methyl-5-oxidanylidene-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
MOLECULAR FORMULA: C19H16F3NO5
MOLECULAR WEIGHT: 395.32925
SMILES: CCOC(=O)C1=C(OC2=C([C@H]1C3=CC(=CC=C3)C(F)(F)F)C(=O)OC(=C2)C)N
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Product OPENEYE NAME: ethyl (4S)-2-amino-7-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
CAS Name: (4S)-2-amino-7-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (4S)-2-amino-7-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
SYSTEMATIC NAME: ethyl (4S)-2-azanyl-7-methyl-5-oxidanylidene-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
MOLECULAR FORMULA: C19H16F3NO5
MOLECULAR WEIGHT: 395.32925
SMILES: CCOC(=O)C1=C(OC2=C([C@@H]1C3=CC(=CC=C3)C(F)(F)F)C(=O)OC(=C2)C)N
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Product OPENEYE NAME: (4R)-6-amino-3-ethyl-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CAS Name: (4R)-6-amino-3-ethyl-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC NAME: (4R)-6-amino-3-ethyl-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: (4R)-6-azanyl-3-ethyl-4-[4-(trifluoromethyloxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C16H13F3N4O2
MOLECULAR WEIGHT: 350.29523
SMILES: CCC1=C2[C@@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: (4S)-6-amino-3-ethyl-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CAS Name: (4S)-6-amino-3-ethyl-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC NAME: (4S)-6-amino-3-ethyl-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: (4S)-6-azanyl-3-ethyl-4-[4-(trifluoromethyloxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C16H13F3N4O2
MOLECULAR WEIGHT: 350.29523
SMILES: CCC1=C2[C@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: methyl (4R)-2-amino-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]chromene-3-carboxylate
CAS Name: (4R)-2-amino-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c][1]benzopyran-3-carboxylic acid methyl ester
IUPAC NAME: methyl (4R)-2-amino-5-oxo-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]chromene-3-carboxylate
SYSTEMATIC NAME: methyl (4R)-2-azanyl-5-oxidanylidene-4-[3-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]chromene-3-carboxylate
MOLECULAR FORMULA: C21H14F3NO5
MOLECULAR WEIGHT: 417.33477
SMILES: COC(=O)C1=C(OC2=C([C@H]1C3=CC(=CC=C3)C(F)(F)F)C(=O)OC4=CC=CC=C42)N
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Product OPENEYE NAME: (4R)-6-amino-3-(methoxymethyl)-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CAS Name: (4R)-6-amino-3-(methoxymethyl)-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC NAME: (4R)-6-amino-3-(methoxymethyl)-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: (4R)-6-azanyl-3-(methoxymethyl)-4-[4-(trifluoromethyloxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C16H13F3N4O3
MOLECULAR WEIGHT: 366.29463
SMILES: COCC1=C2[C@@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: (4S)-6-amino-3-(methoxymethyl)-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CAS Name: (4S)-6-amino-3-(methoxymethyl)-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC NAME: (4S)-6-amino-3-(methoxymethyl)-4-[4-(trifluoromethoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: (4S)-6-azanyl-3-(methoxymethyl)-4-[4-(trifluoromethyloxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C16H13F3N4O3
MOLECULAR WEIGHT: 366.29463
SMILES: COCC1=C2[C@H](C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 2-[5-(2-cyanophenyl)tetrazol-2-yl]-N-(1-naphthylmethyleneamino)acetamide
CAS Name: 2-[5-(2-cyanophenyl)-2-tetrazolyl]-N-(1-naphthalenylmethylideneamino)acetamide
IUPAC NAME: 2-[5-(2-cyanophenyl)tetrazol-2-yl]-N-(naphthalen-1-ylmethylideneamino)acetamide
SYSTEMATIC NAME: 2-[5-(2-cyanophenyl)-1,2,3,4-tetrazol-2-yl]-N-(naphthalen-1-ylmethylideneamino)ethanamide
MOLECULAR FORMULA: C21H15N7O
MOLECULAR WEIGHT: 381.3901
SMILES: C1=CC=C2C(=C1)C=CC=C2C=NNC(=O)CN3N=C(N=N3)C4=CC=CC=C4C#N
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Product OPENEYE NAME: N4-(3-chloro-4-methyl-phenyl)-N2,N2-diethyl-N6-(2-furylmethyl)-1,3,5-triazine-2,4,6-triamine
CAS Name: N4-(3-chloro-4-methylphenyl)-N2,N2-diethyl-N6-(2-furanylmethyl)-1,3,5-triazine-2,4,6-triamine
IUPAC NAME: 4-N-(3-chloro-4-methylphenyl)-2-N,2-N-diethyl-6-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
SYSTEMATIC NAME: N4-(3-chloranyl-4-methyl-phenyl)-N2,N2-diethyl-N6-(furan-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
MOLECULAR FORMULA: C19H23ClN6O
MOLECULAR WEIGHT: 386.87852
SMILES: CCN(CC)C1=NC(=NC(=N1)NCC2=CC=CO2)NC3=CC(=C(C=C3)C)Cl
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Product OPENEYE NAME: N2-(2,5-dimethylphenyl)-N4-(2-furylmethyl)-6-morpholino-1,3,5-triazine-2,4-diamine
CAS Name: N2-(2,5-dimethylphenyl)-N4-(2-furanylmethyl)-6-(4-morpholinyl)-1,3,5-triazine-2,4-diamine
IUPAC NAME: 2-N-(2,5-dimethylphenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2-(2,5-dimethylphenyl)-N4-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C20H24N6O2
MOLECULAR WEIGHT: 380.44356
SMILES: CC1=CC(=C(C=C1)C)NC2=NC(=NC(=N2)N3CCOCC3)NCC4=CC=CO4
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Product OPENEYE NAME: 2-(4-bromophenyl)-5-methyl-4-[(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]-1H-pyrazol-3-one
CAS Name: 2-(4-bromophenyl)-5-methyl-4-[(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]-1H-pyrazol-3-one
IUPAC NAME: 2-(4-bromophenyl)-5-methyl-4-[(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]-1H-pyrazol-3-one
SYSTEMATIC NAME: 2-(4-bromophenyl)-5-methyl-4-[(3-methyl-5-oxidanylidene-1H-pyrazol-4-ylidene)methyl]-1H-pyrazol-3-one
MOLECULAR FORMULA: C15H13BrN4O2
MOLECULAR WEIGHT: 361.19332
SMILES: CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Br)C=C3C(=NNC3=O)C
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Product OPENEYE NAME: 4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylene]-5-methyl-2-(m-tolyl)pyrazol-3-one
CAS Name: 4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-5-methyl-2-(3-methylphenyl)-3-pyrazolone
IUPAC NAME: 4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-5-methyl-2-(3-methylphenyl)pyrazol-3-one
SYSTEMATIC NAME: 4-[[2-(4-bromophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]-5-methyl-2-(3-methylphenyl)pyrazol-3-one
MOLECULAR FORMULA: C22H19BrN4O2
MOLECULAR WEIGHT: 451.31586
SMILES: CC1=CC(=CC=C1)N2C(=O)C(=CC3=C(NN(C3=O)C4=CC=C(C=C4)Br)C)C(=N2)C
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Product OPENEYE NAME: (4Z)-2-(4-bromophenyl)-5-methyl-4-[[5-methyl-2-(o-tolyl)-3-oxo-1H-pyrazol-4-yl]methylene]pyrazol-3-one
CAS Name: (4Z)-2-(4-bromophenyl)-5-methyl-4-[[5-methyl-2-(2-methylphenyl)-3-oxo-1H-pyrazol-4-yl]methylidene]-3-pyrazolone
IUPAC NAME: (4Z)-2-(4-bromophenyl)-5-methyl-4-[[5-methyl-2-(2-methylphenyl)-3-oxo-1H-pyrazol-4-yl]methylidene]pyrazol-3-one
SYSTEMATIC NAME: (4Z)-2-(4-bromophenyl)-5-methyl-4-[[5-methyl-2-(2-methylphenyl)-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]pyrazol-3-one
MOLECULAR FORMULA: C22H19BrN4O2
MOLECULAR WEIGHT: 451.31586
SMILES: CC1=CC=CC=C1N2C(=O)C(=C(N2)C)/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)Br)C
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Product OPENEYE NAME: 2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylene]-5-methyl-pyrazol-3-one
CAS Name: 2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-5-methyl-3-pyrazolone
IUPAC NAME: 2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-5-methylpyrazol-3-one
SYSTEMATIC NAME: 2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]-5-methyl-pyrazol-3-one
MOLECULAR FORMULA: C21H16Br2N4O2
MOLECULAR WEIGHT: 516.18534
SMILES: CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Br)C=C3C(=NN(C3=O)C4=CC=C(C=C4)Br)C
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Product OPENEYE NAME: (4Z)-2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylene]-5-methyl-pyrazol-3-one
CAS Name: (4Z)-2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-5-methyl-3-pyrazolone
IUPAC NAME: (4Z)-2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]methylidene]-5-methylpyrazol-3-one
SYSTEMATIC NAME: (4Z)-2-(4-bromophenyl)-4-[[2-(4-bromophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]methylidene]-5-methyl-pyrazol-3-one
MOLECULAR FORMULA: C21H16Br2N4O2
MOLECULAR WEIGHT: 516.18534
SMILES: CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Br)/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)Br)C
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