Sunday, December 25, 2011

All Chemical Compounds Information



Product OPENEYE NAME: 4-[3-[benzyl(methyl)amino]-1H-pyridazin-6-ylidene]-2,6-dichloro-cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[methyl-(phenylmethyl)amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 4-[3-[benzyl(methyl)amino]-1H-pyridazin-6-ylidene]-2,6-dichlorocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[methyl-(phenylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C18H15Cl2N3O
MOLECULAR WEIGHT: 360.2372
SMILES: CN(CC1=CC=CC=C1)C2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=C2
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Product OPENEYE NAME: 4-(3-benzyloxy-1H-pyridazin-6-ylidene)-2,6-dichloro-cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-(3-phenylmethoxy-1H-pyridazin-6-ylidene)-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-(3-phenylmethoxy-1H-pyridazin-6-ylidene)cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-(3-phenylmethoxy-1H-pyridazin-6-ylidene)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C17H12Cl2N2O2
MOLECULAR WEIGHT: 347.19538
SMILES: C1=CC=C(C=C1)COC2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=C2
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[methyl-[[3-(2-pyridyloxy)phenyl]methyl]amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[methyl-[[3-(2-pyridinyloxy)phenyl]methyl]amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[methyl-[(3-pyridin-2-yloxyphenyl)methyl]amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[methyl-[(3-pyridin-2-yloxyphenyl)methyl]amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C23H18Cl2N4O2
MOLECULAR WEIGHT: 453.32062
SMILES: CN(CC1=CC(=CC=C1)OC2=CC=CC=N2)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-difluorophenyl)methyl-methyl-amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[(3,4-difluorophenyl)methyl-methylamino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[(3,4-difluorophenyl)methyl-methylamino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[3-[[3,4-bis(fluoranyl)phenyl]methyl-methyl-amino]-1H-pyridazin-6-ylidene]-2,6-bis(chloranyl)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C18H13Cl2F2N3O
MOLECULAR WEIGHT: 396.218126
SMILES: CN(CC1=CC(=C(C=C1)F)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-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C19H15Cl2N3O
MOLECULAR WEIGHT: 372.2479
SMILES: C1CN(CC2=CC=CC=C21)C3=NNC(=C4C=C(C(=O)C(=C4)Cl)Cl)C=C3
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Product OPENEYE NAME: 2,6-dichloro-4-[3-[(2,3-dichlorophenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[(2,3-dichlorophenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[(2,3-dichlorophenyl)methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[3-[[2,3-bis(chloranyl)phenyl]methyl-(2-hydroxyethyl)amino]-1H-pyridazin-6-ylidene]-2,6-bis(chloranyl)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C19H15Cl4N3O2
MOLECULAR WEIGHT: 459.1533
SMILES: C1=CC(=C(C(=C1)Cl)Cl)CN(CCO)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(3-pyridylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[methyl(3-pyridinylmethyl)amino]-1H-pyridazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dichloro-4-[3-[methyl(pyridin-3-ylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[methyl(pyridin-3-ylmethyl)amino]-1H-pyridazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C17H14Cl2N4O
MOLECULAR WEIGHT: 361.22526
SMILES: CN(CC1=CN=CC=C1)C2=NNC(=C3C=C(C(=O)C(=C3)Cl)Cl)C=C2
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Product OPENEYE NAME: (2S)-2-[[(2S)-4-carboxy-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]butanoyl]amino]-4-methyl-pentanoyl]amino]butanoyl]amino]-4-methyl-pentanoic acid
CAS Name: (2S)-2-[[(2S)-4-carboxy-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-4-methyl-1-oxo-2-[[oxo-[(2S)-2-pyrrolidinyl]methyl]amino]pentyl]amino]-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxobutyl]amino]-4-methylpentanoic acid
IUPAC NAME: (2S)-2-[[(2S)-4-carboxy-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]butanoyl]amino]-4-methylpentanoyl]amino]butanoyl]amino]-4-methylpentanoic acid
SYSTEMATIC NAME: (2S)-4-methyl-2-[[(2S)-2-[[(2S)-4-methyl-2-[[(2S,3R)-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]pentanoyl]amino]-3-oxidanyl-butanoyl]amino]pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]pentanoic acid
MOLECULAR FORMULA: C32H56N6O10
MOLECULAR WEIGHT: 684.82124
SMILES: C[C@H]([C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)O
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Product OPENEYE NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2,5-diamino-5-oxo-pentanoyl]pyrrolidine-2-carbonyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid
CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[[(2S)-1-[(2S)-2,5-diamino-1,5-dioxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-4-methylpentanoic acid
IUPAC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2,5-diamino-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2,5-bis(azanyl)-5-oxidanylidene-pentanoyl]pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid
MOLECULAR FORMULA: C39H60N8O8
MOLECULAR WEIGHT: 768.9425
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCC(=O)N)N
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Product OPENEYE NAME: (2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-4-methylsulfanyl-butanoyl]amino]-5-oxo-pentanoyl]amino]-3-methyl-butanoyl]amino]-3-hydroxy-butanoyl]amino]-3-carboxy-propanoyl]amino]butanedioic acid
CAS Name: (2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-4-(methylthio)-1-oxobutyl]amino]-1,5-dioxopentyl]amino]-3-methyl-1-oxobutyl]amino]-3-hydroxy-1-oxobutyl]amino]-3-carboxy-1-oxopropyl]amino]butanedioic acid
IUPAC NAME: (2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-carboxypropanoyl]amino]butanedioic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-azanyl-4-methylsulfanyl-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-3-methyl-butanoyl]amino]-3-oxidanyl-butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]butanedioic acid
MOLECULAR FORMULA: C27H45N7O13S
MOLECULAR WEIGHT: 707.7503
SMILES: C[C@H]([C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCSC)N)O
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Product OPENEYE NAME: N-[2-fluoro-4-(1-piperidyl)phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxo-acetamide
CAS Name: N-[2-fluoro-4-(1-piperidinyl)phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-2-pyrrolyl]-2-oxoacetamide
IUPAC NAME: N-(2-fluoro-4-piperidin-1-ylphenyl)-2-[1-(2-methoxyethyl)-5-methyl-3-phenylpyrrol-2-yl]-2-oxoacetamide
SYSTEMATIC NAME: N-(2-fluoranyl-4-piperidin-1-yl-phenyl)-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxidanylidene-ethanamide
MOLECULAR FORMULA: C27H30FN3O3
MOLECULAR WEIGHT: 463.543803
SMILES: CC1=CC(=C(N1CCOC)C(=O)C(=O)NC2=C(C=C(C=C2)N3CCCCC3)F)C4=CC=CC=C4
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Product OPENEYE NAME: N-[4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-fluoro-phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxo-acetamide
CAS Name: N-[4-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-fluorophenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-2-pyrrolyl]-2-oxoacetamide
IUPAC NAME: N-[4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-fluorophenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenylpyrrol-2-yl]-2-oxoacetamide
SYSTEMATIC NAME: N-[4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-fluoranyl-phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxidanylidene-ethanamide
MOLECULAR FORMULA: C31H39FN4O3
MOLECULAR WEIGHT: 534.664763
SMILES: CC1=CC(=C(N1CCOC)C(=O)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)CC(C)(C)C)F)C4=CC=CC=C4
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Product OPENEYE NAME: 2-(1,5-dimethyl-3-phenyl-pyrrol-2-yl)-N-[4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-fluoro-phenyl]-2-oxo-acetamide
CAS Name: 2-(1,5-dimethyl-3-phenyl-2-pyrrolyl)-N-[4-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-fluorophenyl]-2-oxoacetamide
IUPAC NAME: 2-(1,5-dimethyl-3-phenylpyrrol-2-yl)-N-[4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-fluorophenyl]-2-oxoacetamide
SYSTEMATIC NAME: 2-(1,5-dimethyl-3-phenyl-pyrrol-2-yl)-N-[4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-fluoranyl-phenyl]-2-oxidanylidene-ethanamide
MOLECULAR FORMULA: C29H35FN4O2
MOLECULAR WEIGHT: 490.612203
SMILES: CC1=CC(=C(N1C)C(=O)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)CC(C)(C)C)F)C4=CC=CC=C4
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Product OPENEYE NAME: N-[2-fluoro-5-(4-isobutylpiperazin-1-yl)phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxo-acetamide
CAS Name: N-[2-fluoro-5-[4-(2-methylpropyl)-1-piperazinyl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-2-pyrrolyl]-2-oxoacetamide
IUPAC NAME: N-[2-fluoro-5-[4-(2-methylpropyl)piperazin-1-yl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenylpyrrol-2-yl]-2-oxoacetamide
SYSTEMATIC NAME: N-[2-fluoranyl-5-[4-(2-methylpropyl)piperazin-1-yl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxidanylidene-ethanamide
MOLECULAR FORMULA: C30H37FN4O3
MOLECULAR WEIGHT: 520.638183
SMILES: CC1=CC(=C(N1CCOC)C(=O)C(=O)NC2=C(C=CC(=C2)N3CCN(CC3)CC(C)C)F)C4=CC=CC=C4
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Product OPENEYE NAME: N-[2-fluoro-4-[4-(2-methylallyl)piperazin-1-yl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxo-acetamide
CAS Name: N-[2-fluoro-4-[4-(2-methylprop-2-enyl)-1-piperazinyl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-2-pyrrolyl]-2-oxoacetamide
IUPAC NAME: N-[2-fluoro-4-[4-(2-methylprop-2-enyl)piperazin-1-yl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenylpyrrol-2-yl]-2-oxoacetamide
SYSTEMATIC NAME: N-[2-fluoranyl-4-[4-(2-methylprop-2-enyl)piperazin-1-yl]phenyl]-2-[1-(2-methoxyethyl)-5-methyl-3-phenyl-pyrrol-2-yl]-2-oxidanylidene-ethanamide
MOLECULAR FORMULA: C30H35FN4O3
MOLECULAR WEIGHT: 518.622303
SMILES: CC1=CC(=C(N1CCOC)C(=O)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)CC(=C)C)F)C4=CC=CC=C4
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Product OPENEYE NAME: 7-[(E)-2-(3-pyridyl)vinyl]-6-[4-(trifluoromethyl)phenyl]thiazolo[3,2-a]pyrimidin-5-one
CAS Name: 7-[(E)-2-(3-pyridinyl)ethenyl]-6-[4-(trifluoromethyl)phenyl]-5-thiazolo[3,2-a]pyrimidinone
IUPAC NAME: 7-[(E)-2-pyridin-3-ylethenyl]-6-[4-(trifluoromethyl)phenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SYSTEMATIC NAME: 7-[(E)-2-pyridin-3-ylethenyl]-6-[4-(trifluoromethyl)phenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
MOLECULAR FORMULA: C20H12F3N3OS
MOLECULAR WEIGHT: 399.38899
SMILES: C1=CC(=CN=C1)/C=C/C2=C(C(=O)N3C=CSC3=N2)C4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-(2-isobutoxy-3-methoxy-phenyl)vinyl]thiazolo[3,2-a]pyrimidin-5-one
CAS Name: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[3-methoxy-2-(2-methylpropoxy)phenyl]ethenyl]-5-thiazolo[3,2-a]pyrimidinone
IUPAC NAME: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[3-methoxy-2-(2-methylpropoxy)phenyl]ethenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SYSTEMATIC NAME: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[3-methoxy-2-(2-methylpropoxy)phenyl]ethenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
MOLECULAR FORMULA: C27H29N3O3S
MOLECULAR WEIGHT: 475.60246
SMILES: CC(C)COC1=C(C=CC=C1OC)/C=C/C2=C(C(=O)N3C=CSC3=N2)C4=CC=C(C=C4)N(C)C
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Product OPENEYE NAME: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[2-(2,2-dimethylpropoxy)-3-methoxy-phenyl]vinyl]thiazolo[3,2-a]pyrimidin-5-one
CAS Name: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[2-(2,2-dimethylpropoxy)-3-methoxyphenyl]ethenyl]-5-thiazolo[3,2-a]pyrimidinone
IUPAC NAME: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[2-(2,2-dimethylpropoxy)-3-methoxyphenyl]ethenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SYSTEMATIC NAME: 6-[4-(dimethylamino)phenyl]-7-[(E)-2-[2-(2,2-dimethylpropoxy)-3-methoxy-phenyl]ethenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
MOLECULAR FORMULA: C28H31N3O3S
MOLECULAR WEIGHT: 489.62904
SMILES: CC(C)(C)COC1=C(C=CC=C1OC)/C=C/C2=C(C(=O)N3C=CSC3=N2)C4=CC=C(C=C4)N(C)C
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Product OPENEYE NAME: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]vinyl]-6-(4-methoxyphenyl)thiazolo[3,2-a]pyrimidin-5-one
CAS Name: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxyphenyl]ethenyl]-6-(4-methoxyphenyl)-5-thiazolo[3,2-a]pyrimidinone
IUPAC NAME: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxyphenyl]ethenyl]-6-(4-methoxyphenyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SYSTEMATIC NAME: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]ethenyl]-6-(4-methoxyphenyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
MOLECULAR FORMULA: C26H24N2O4S
MOLECULAR WEIGHT: 460.54476
SMILES: COC1=CC=C(C=C1)C2=C(N=C3N(C2=O)C=CS3)/C=C/C4=C(C(=CC=C4)OC)OCC5CC5
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Product OPENEYE NAME: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]vinyl]-6-(4-ethoxyphenyl)thiazolo[3,2-a]pyrimidin-5-one
CAS Name: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxyphenyl]ethenyl]-6-(4-ethoxyphenyl)-5-thiazolo[3,2-a]pyrimidinone
IUPAC NAME: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxyphenyl]ethenyl]-6-(4-ethoxyphenyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SYSTEMATIC NAME: 7-[(E)-2-[2-(cyclopropylmethoxy)-3-methoxy-phenyl]ethenyl]-6-(4-ethoxyphenyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
MOLECULAR FORMULA: C27H26N2O4S
MOLECULAR WEIGHT: 474.57134
SMILES: CCOC1=CC=C(C=C1)C2=C(N=C3N(C2=O)C=CS3)/C=C/C4=C(C(=CC=C4)OC)OCC5CC5
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Product OPENEYE NAME: 6-[[5-fluoro-4-[4-(hydroxymethyl)-1-piperidyl]pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
CAS Name: 6-[[5-fluoro-4-[4-(hydroxymethyl)-1-piperidinyl]-2-pyrimidinyl]amino]-3,4-dihydro-1H-quinolin-2-one
IUPAC NAME: 6-[[5-fluoro-4-[4-(hydroxymethyl)piperidin-1-yl]pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
SYSTEMATIC NAME: 6-[[5-fluoranyl-4-[4-(hydroxymethyl)piperidin-1-yl]pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
MOLECULAR FORMULA: C19H22FN5O2
MOLECULAR WEIGHT: 371.408683
SMILES: C1CN(CCC1CO)C2=NC(=NC=C2F)NC3=CC4=C(C=C3)NC(=O)CC4
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Product OPENEYE NAME: 2-[4-(4-acetylpiperazin-1-yl)anilino]-4-[4-(aminomethyl)-1-piperidyl]pyrimidine-5-carboxamide
CAS Name: 2-[4-(4-acetyl-1-piperazinyl)anilino]-4-[4-(aminomethyl)-1-piperidinyl]-5-pyrimidinecarboxamide
IUPAC NAME: 2-[4-(4-acetylpiperazin-1-yl)anilino]-4-[4-(aminomethyl)piperidin-1-yl]pyrimidine-5-carboxamide
SYSTEMATIC NAME: 4-[4-(aminomethyl)piperidin-1-yl]-2-[[4-(4-ethanoylpiperazin-1-yl)phenyl]amino]pyrimidine-5-carboxamide
MOLECULAR FORMULA: C23H32N8O2
MOLECULAR WEIGHT: 452.55258
SMILES: CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=N3)N4CCC(CC4)CN)C(=O)N
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Product OPENEYE NAME: 1-[5-fluoro-2-(1H-indazol-6-ylamino)pyrimidin-4-yl]piperidine-3-carboxamide
CAS Name: 1-[5-fluoro-2-(1H-indazol-6-ylamino)-4-pyrimidinyl]-3-piperidinecarboxamide
IUPAC NAME: 1-[5-fluoro-2-(1H-indazol-6-ylamino)pyrimidin-4-yl]piperidine-3-carboxamide
SYSTEMATIC NAME: 1-[5-fluoranyl-2-(1H-indazol-6-ylamino)pyrimidin-4-yl]piperidine-3-carboxamide
MOLECULAR FORMULA: C17H18FN7O
MOLECULAR WEIGHT: 355.369523
SMILES: C1CC(CN(C1)C2=NC(=NC=C2F)NC3=CC4=C(C=C3)C=NN4)C(=O)N
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