Friday, December 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]morpholine-4-carboxamide
CAS Name: N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]phenyl]-4-morpholinecarboxamide
IUPAC NAME: N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]morpholine-4-carboxamide
SYSTEMATIC NAME: N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]morpholine-4-carboxamide
MOLECULAR FORMULA: C20H24N8O2
MOLECULAR WEIGHT: 408.45696
SMILES: CC1=C(C=C(C=C1)NC2=CN=CC(=N2)NC3=NNC(=C3)C)NC(=O)N4CCOCC4
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Product OPENEYE NAME: 1-isopropyl-3-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]urea
CAS Name: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]phenyl]-3-propan-2-ylurea
IUPAC NAME: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]-3-propan-2-ylurea
SYSTEMATIC NAME: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]-3-propan-2-yl-urea
MOLECULAR FORMULA: C19H24N8O
MOLECULAR WEIGHT: 380.44686
SMILES: CC1=C(C=C(C=C1)NC2=CN=CC(=N2)NC3=NNC(=C3)C)NC(=O)NC(C)C
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Product OPENEYE NAME: N6-[3-(cyclopentylamino)-4-methyl-phenyl]-N2-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
CAS Name: N6-[3-(cyclopentylamino)-4-methylphenyl]-N2-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
IUPAC NAME: 6-N-[3-(cyclopentylamino)-4-methylphenyl]-2-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
SYSTEMATIC NAME: N6-[3-(cyclopentylamino)-4-methyl-phenyl]-N2-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
MOLECULAR FORMULA: C20H25N7
MOLECULAR WEIGHT: 363.4594
SMILES: CC1=C(C=C(C=C1)NC2=CN=CC(=N2)NC3=NNC(=C3)C)NC4CCCC4
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Product OPENEYE NAME: 8-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-1,3,4,5-tetrahydro-1-benzazepin-2-one
CAS Name: 8-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]-1,3,4,5-tetrahydro-1-benzazepin-2-one
IUPAC NAME: 8-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-1,3,4,5-tetrahydro-1-benzazepin-2-one
SYSTEMATIC NAME: 8-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-1,3,4,5-tetrahydro-1-benzazepin-2-one
MOLECULAR FORMULA: C18H19N7O
MOLECULAR WEIGHT: 349.38976
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)NC3=CC4=C(CCCC(=O)N4)C=C3
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Product OPENEYE NAME: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]-3-phenyl-urea
CAS Name: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]phenyl]-3-phenylurea
IUPAC NAME: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]-3-phenylurea
SYSTEMATIC NAME: 1-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]-3-phenyl-urea
MOLECULAR FORMULA: C22H22N8O
MOLECULAR WEIGHT: 414.46308
SMILES: CC1=C(C=C(C=C1)NC2=CN=CC(=N2)NC3=NNC(=C3)C)NC(=O)NC4=CC=CC=C4
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C32H36N4O6
MOLECULAR WEIGHT: 572.65144
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NCC4=CC=CC=C4)OC5=NC6=CC=CC=C6O5)C(=O)O
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MOLECULAR FORMULA: C31H34N4O5S
MOLECULAR WEIGHT: 574.69046
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC=CC=C4)OC5=NC6=CC=CC=C6S5)C(=O)O
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MOLECULAR FORMULA: C32H36N4O6S
MOLECULAR WEIGHT: 604.71644
SMILES: COC1=CC2=C(C=C1)N=C(S2)O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)NC6=CC=CC=C6)C(=O)O
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MOLECULAR FORMULA: C31H33FN4O5S
MOLECULAR WEIGHT: 592.680923
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC=CC=C4)OC5=NC6=C(S5)C=C(C=C6)F)C(=O)O
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MOLECULAR FORMULA: C35H40FN5O7S2
MOLECULAR WEIGHT: 725.849803
SMILES: COC1=CC2=C(C=C1)N=C(S2)O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)NC6=CC(=CC=C6)F)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C34H37F2N5O6S2
MOLECULAR WEIGHT: 713.814286
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC(=CC=C4)F)OC5=NC6=C(S5)C=C(C=C6)F)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C34H37ClFN5O6S2
MOLECULAR WEIGHT: 730.268883
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC(=CC=C4)F)OC5=NC6=C(S5)C=C(C=C6)Cl)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C36H42FN5O6S2
MOLECULAR WEIGHT: 723.876983
SMILES: CC/1CCCC[C@@H](C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@]3(C[C@H]3/C=C1)C(=O)NS(=O)(=O)C4CC4)OC5=NC6=C(S5)C=C(C=C6)C)NC7=CC(=CC=C7)F
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-(2-morpholinosulfonylethyl)indazole-4-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-[2-(4-morpholinylsulfonyl)ethyl]-4-indazolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)indazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)indazole-4-carboxamide
MOLECULAR FORMULA: C20H21FN4O4S
MOLECULAR WEIGHT: 432.468543
SMILES: C1COCCN1S(=O)(=O)CCNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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Product OPENEYE NAME: N-[3-(dimethylsulfamoyl)propyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CAS Name: N-[3-(dimethylsulfamoyl)propyl]-1-(4-fluorophenyl)-4-indazolecarboxamide
IUPAC NAME: N-[3-(dimethylsulfamoyl)propyl]-1-(4-fluorophenyl)indazole-4-carboxamide
SYSTEMATIC NAME: N-[3-(dimethylsulfamoyl)propyl]-1-(4-fluorophenyl)indazole-4-carboxamide
MOLECULAR FORMULA: C19H21FN4O3S
MOLECULAR WEIGHT: 404.458443
SMILES: CN(C)S(=O)(=O)CCCNC(=O)C1=C2C=NN(C2=CC=C1)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[(2-chloro-4-methylsulfonyl-phenyl)methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CAS Name: N-[(2-chloro-4-methylsulfonylphenyl)methyl]-1-(4-fluorophenyl)-4-indazolecarboxamide
IUPAC NAME: N-[(2-chloro-4-methylsulfonylphenyl)methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
SYSTEMATIC NAME: N-[(2-chloranyl-4-methylsulfonyl-phenyl)methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
MOLECULAR FORMULA: C22H17ClFN3O3S
MOLECULAR WEIGHT: 457.905083
SMILES: CS(=O)(=O)C1=CC(=C(C=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F)Cl
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Product OPENEYE NAME: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CAS Name: N-[[4-[dimethylamino(oxo)methyl]phenyl]methyl]-1-(4-fluorophenyl)-4-indazolecarboxamide
IUPAC NAME: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
SYSTEMATIC NAME: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
MOLECULAR FORMULA: C24H21FN4O2
MOLECULAR WEIGHT: 416.447543
SMILES: CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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