Monday, December 26, 2011

All Chemical Compounds Information



Product OPENEYE NAME: N-[3-[2-amino-7-methoxy-8-(4-pyridyl)quinazolin-6-yl]-4-methyl-phenyl]-2-fluoro-5-(trifluoromethyl)benzamide
CAS Name: N-[3-(2-amino-7-methoxy-8-pyridin-4-yl-6-quinazolinyl)-4-methylphenyl]-2-fluoro-5-(trifluoromethyl)benzamide
IUPAC NAME: N-[3-(2-amino-7-methoxy-8-pyridin-4-ylquinazolin-6-yl)-4-methylphenyl]-2-fluoro-5-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-[3-(2-azanyl-7-methoxy-8-pyridin-4-yl-quinazolin-6-yl)-4-methyl-phenyl]-2-fluoranyl-5-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C29H21F4N5O2
MOLECULAR WEIGHT: 547.502953
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)C(F)(F)F)F)C3=C(C(=C4C(=C3)C=NC(=N4)N)C5=CC=NC=C5)OC
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Product OPENEYE NAME: (2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-4-oxo-butanoic acid
CAS Name: (2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-(methylthio)-1-oxobutyl]amino]-4-oxobutanoic acid
IUPAC NAME: (2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-oxobutanoic acid
SYSTEMATIC NAME: (2S)-4-azanyl-2-[[(2S)-2-[[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C32H43N7O9S
MOLECULAR WEIGHT: 701.79032
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
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Product OPENEYE NAME: (2S)-4-amino-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-4-methyl-pentanoyl]amino]-4-oxo-butanoic acid
CAS Name: (2S)-4-amino-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-4-methyl-1-oxopentyl]amino]-4-oxobutanoic acid
IUPAC NAME: (2S)-4-amino-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]-4-oxobutanoic acid
SYSTEMATIC NAME: (2S)-4-azanyl-2-[[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-4-methyl-pentanoyl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C24H36N6O8
MOLECULAR WEIGHT: 536.57804
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@H](CC1=CC=C(C=C1)O)N
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Product OPENEYE NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]pentanedioic acid
CAS Name: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methyl-1-oxopentyl]amino]pentanedioic acid
IUPAC NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[(2S,3S)-2-[[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]pentanedioic acid
MOLECULAR FORMULA: C34H46N6O10
MOLECULAR WEIGHT: 698.76324
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C20H18Cl2FN3O2
MOLECULAR WEIGHT: 422.280223
SMILES: CCN(CC1=CC(=C(C=C1)OC)F)C2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=C2
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[methyl(6-quinolylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[methyl(6-quinolinylmethyl)amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[methyl(quinolin-6-ylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[methyl(quinolin-6-ylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H16Cl2N4O
MOLECULAR WEIGHT: 411.28394
SMILES: CN(CC1=CC2=C(C=C1)N=CC=C2)C3=NNC(=C4C=C(C(=O)C(=C4)Cl)Cl)C=C3
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Product OPENEYE NAME: 2,6-dichloro-4-[3-(dibenzylamino)-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 4-[3-[bis(phenylmethyl)amino]-1H-pyridazin-6-ylidene]-2,6-dichloro-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-(dibenzylamino)-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[3-[bis(phenylmethyl)amino]-1H-pyridazin-6-ylidene]-2,6-bis(chloranyl)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C24H19Cl2N3O
MOLECULAR WEIGHT: 436.33316
SMILES: C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NNC(=C4C=C(C(=O)C(=C4)Cl)Cl)C=C3
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[(3,4-dimethoxyphenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[(3,4-dimethoxyphenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[(3,4-dimethoxyphenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[(3,4-dimethoxyphenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H21Cl2N3O4
MOLECULAR WEIGHT: 450.31514
SMILES: COC1=C(C=C(C=C1)CN(CCO)C2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=C2)OC
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[4-(3-fluorophenyl)piperazin-1-yl]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[4-(3-fluorophenyl)-1-piperazinyl]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[4-(3-fluorophenyl)piperazin-1-yl]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[4-(3-fluorophenyl)piperazin-1-yl]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C20H17Cl2FN4O
MOLECULAR WEIGHT: 419.279583
SMILES: C1CN(CCN1C2=CC(=CC=C2)F)C3=NNC(=C4C=C(C(=O)C(=C4)Cl)Cl)C=C3
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