Wednesday, December 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: N-(2-amino-2-oxo-ethyl)-3-(4-chloroanilino)-N-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazine-2-carboxamide
CAS Name: N-(2-amino-2-oxoethyl)-3-(4-chloroanilino)-N-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinecarboxamide
IUPAC NAME: N-(2-amino-2-oxoethyl)-3-(4-chloroanilino)-N-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazine-2-carboxamide
SYSTEMATIC NAME: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[(4-chlorophenyl)amino]-N-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazine-2-carboxamide
MOLECULAR FORMULA: C18H19ClN8O2
MOLECULAR WEIGHT: 414.84886
SMILES: CC1=CC(=NN1)NC2=CN=C(C(=N2)NC3=CC=C(C=C3)Cl)C(=O)N(C)CC(=O)N
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Product OPENEYE NAME: [3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]-(3-hydroxy-1-piperidyl)methanone
CAS Name: [3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]-(3-hydroxy-1-piperidinyl)methanone
IUPAC NAME: [3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]-(3-hydroxypiperidin-1-yl)methanone
SYSTEMATIC NAME: [3-[(4-chlorophenyl)amino]-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]-(3-oxidanylpiperidin-1-yl)methanone
MOLECULAR FORMULA: C20H22ClN7O2
MOLECULAR WEIGHT: 427.88738
SMILES: CC1=CC(=NN1)NC2=CN=C(C(=N2)NC3=CC=C(C=C3)Cl)C(=O)N4CCCC(C4)O
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Product OPENEYE NAME: [(2R)-2-(aminomethyl)pyrrolidin-1-yl]-[3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]methanone
CAS Name: [(2R)-2-(aminomethyl)-1-pyrrolidinyl]-[3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]methanone
IUPAC NAME: [(2R)-2-(aminomethyl)pyrrolidin-1-yl]-[3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]methanone
SYSTEMATIC NAME: [(2R)-2-(aminomethyl)pyrrolidin-1-yl]-[3-[(4-chlorophenyl)amino]-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]methanone
MOLECULAR FORMULA: C20H23ClN8O
MOLECULAR WEIGHT: 426.90262
SMILES: CC1=CC(=NN1)NC2=CN=C(C(=N2)NC3=CC=C(C=C3)Cl)C(=O)N4CCC[C@@H]4CN
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Product OPENEYE NAME: N-(azetidin-3-yl)-3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazine-2-carboxamide
CAS Name: N-(3-azetidinyl)-3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinecarboxamide
IUPAC NAME: N-(azetidin-3-yl)-3-(4-chloroanilino)-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazine-2-carboxamide
SYSTEMATIC NAME: N-(azetidin-3-yl)-3-[(4-chlorophenyl)amino]-5-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazine-2-carboxamide
MOLECULAR FORMULA: C18H19ClN8O
MOLECULAR WEIGHT: 398.84946
SMILES: CC1=CC(=NN1)NC2=CN=C(C(=N2)NC3=CC=C(C=C3)Cl)C(=O)NC4CNC4
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Product OPENEYE NAME: methyl N-[5-[[3-(isopropylcarbamoyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-2-methyl-phenyl]carbamate
CAS Name: N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-3-[oxo-(propan-2-ylamino)methyl]-2-pyrazinyl]amino]phenyl]carbamic acid methyl ester
IUPAC NAME: methyl N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-3-(propan-2-ylcarbamoyl)pyrazin-2-yl]amino]phenyl]carbamate
SYSTEMATIC NAME: methyl N-[2-methyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-3-(propan-2-ylcarbamoyl)pyrazin-2-yl]amino]phenyl]carbamate
MOLECULAR FORMULA: C21H26N8O3
MOLECULAR WEIGHT: 438.48294
SMILES: CC1=C(C=C(C=C1)NC2=NC(=CN=C2C(=O)NC(C)C)NC3=NNC(=C3)C)NC(=O)OC
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C34H38ClN5O6S2
MOLECULAR WEIGHT: 712.27842
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)Cl)C(=O)NS(=O)(=O)C7CC7
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C35H41N5O6S2
MOLECULAR WEIGHT: 691.85994
SMILES: CC1=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)NS(=O)(=O)C7CC7
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C34H39N5O7S
MOLECULAR WEIGHT: 661.76776
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=C6O5)C(=O)NS(=O)(=O)C7CC7
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MOLECULAR FORMULA: C35H38F3N5O6S2
MOLECULAR WEIGHT: 745.83133
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)C(F)(F)F)OC5=NC6=CC=CC=C6S5)C(=O)NS(=O)(=O)C7CC7
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Product OPENEYE NAME: (3aS,6S,6aS,9aS,9bR)-8-[(E)-hept-1-enyl]-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,9b-tetrahydro-3aH-azuleno[8,7-b]furan-2,9-dione
CAS Name: (3aS,6S,6aS,9aS,9bR)-8-[(E)-hept-1-enyl]-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,9b-tetrahydro-3aH-azuleno[8,7-b]furan-2,9-dione
IUPAC NAME: (3aS,6S,6aS,9aS,9bR)-8-[(E)-hept-1-enyl]-6a-hydroxy-6,9a-dimethyl-3-methylidene-4,5,6,9b-tetrahydro-3aH-azuleno[8,7-b]furan-2,9-dione
SYSTEMATIC NAME: (3aS,6S,6aS,9aS,9bR)-8-[(E)-hept-1-enyl]-6,9a-dimethyl-3-methylidene-6a-oxidanyl-4,5,6,9b-tetrahydro-3aH-azuleno[8,7-b]furan-2,9-dione
MOLECULAR FORMULA: C22H30O4
MOLECULAR WEIGHT: 358.4712
SMILES: CCCCC/C=C/C1=C[C@]2([C@H](CC[C@@H]3[C@H]([C@@]2(C1=O)C)OC(=O)C3=C)C)O
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