Tuesday, July 24, 2012

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H18ClNOS
MOLECULAR WEIGHT: 295.82752
SMILES: C1CC[C@]23CCN([C@H](C2C1)CC4=C3C=CS4)C(=O)Cl
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H19NS
MOLECULAR WEIGHT: 233.37236
SMILES: C1CC[C@]23CCN[C@H](C2C1)CC4=C3C=CS4
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Product OPENEYE NAME: 2-[(2R)-1-methyl-2-piperidyl]-1H-benzimidazole
CAS Name: 2-[(2R)-1-methyl-2-piperidinyl]-1H-benzimidazole
IUPAC NAME: 2-[(2R)-1-methylpiperidin-2-yl]-1H-benzimidazole
SYSTEMATIC NAME: 2-[(2R)-1-methylpiperidin-2-yl]-1H-benzimidazole
MOLECULAR FORMULA: C13H17N3
MOLECULAR WEIGHT: 215.29418
SMILES: CN1CCCC[C@@H]1C2=NC3=CC=CC=C3N2
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Product OPENEYE NAME: 1-ethyl-1,2,3,4-tetrahydrodibenzothiophene
CAS Name: 1-ethyl-1,2,3,4-tetrahydrodibenzothiophene
IUPAC NAME: 1-ethyl-1,2,3,4-tetrahydrodibenzothiophene
SYSTEMATIC NAME: 1-ethyl-1,2,3,4-tetrahydrodibenzothiophene
MOLECULAR FORMULA: C14H16S
MOLECULAR WEIGHT: 216.34184
SMILES: CCC1CCCC2=C1C3=CC=CC=C3S2
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Product OPENEYE NAME: 3-ethyl-1,2,3,4-tetrahydrodibenzothiophene
CAS Name: 3-ethyl-1,2,3,4-tetrahydrodibenzothiophene
IUPAC NAME: 3-ethyl-1,2,3,4-tetrahydrodibenzothiophene
SYSTEMATIC NAME: 3-ethyl-1,2,3,4-tetrahydrodibenzothiophene
MOLECULAR FORMULA: C14H16S
MOLECULAR WEIGHT: 216.34184
SMILES: CCC1CCC2=C(C1)SC3=CC=CC=C23
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Product OPENEYE NAME: 4-(2-chlorobenzoyl)thiophene-3-carbonyl chloride
CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-3-thiophenecarbonyl chloride
IUPAC NAME: 4-(2-chlorobenzoyl)thiophene-3-carbonyl chloride
SYSTEMATIC NAME: 4-(2-chlorophenyl)carbonylthiophene-3-carbonyl chloride
MOLECULAR FORMULA: C12H6Cl2O2S
MOLECULAR WEIGHT: 285.14584
SMILES: C1=CC=C(C(=C1)C(=O)C2=CSC=C2C(=O)Cl)Cl
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Product OPENEYE NAME: N4-[2,5-diphenyl-4-(2-phenylhydrazino)pyrazol-3-yl]-N3,2,5-triphenyl-pyrazole-3,4-diimine
CAS Name: N4-[2,5-diphenyl-4-(phenylhydrazo)-3-pyrazolyl]-N3,2,5-triphenylpyrazole-3,4-diimine
IUPAC NAME: 4-N-[2,5-diphenyl-4-(2-phenylhydrazinyl)pyrazol-3-yl]-3-N,2,5-triphenylpyrazole-3,4-diimine
SYSTEMATIC NAME: N4-[2,5-diphenyl-4-(2-phenylhydrazinyl)pyrazol-3-yl]-N3,2,5-triphenyl-pyrazole-3,4-diimine
MOLECULAR FORMULA: C42H32N8
MOLECULAR WEIGHT: 648.75708
SMILES: C1=CC=C(C=C1)C2=NN(C(=C2NNC3=CC=CC=C3)/N=C/4\C(=NN(C4=NC5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8
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Product OPENEYE NAME: N-[(Z)-(1,3-diphenyl-5-phenylimino-pyrazol-4-ylidene)amino]aniline
CAS Name: N-[(Z)-(1,3-diphenyl-5-phenylimino-4-pyrazolylidene)amino]aniline
IUPAC NAME: N-[(Z)-(1,3-diphenyl-5-phenyliminopyrazol-4-ylidene)amino]aniline
SYSTEMATIC NAME: N-[(Z)-(1,3-diphenyl-5-phenylimino-pyrazol-4-ylidene)amino]aniline
MOLECULAR FORMULA: C27H21N5
MOLECULAR WEIGHT: 415.48914
SMILES: C1=CC=C(C=C1)C\2=NN(C(=NC3=CC=CC=C3)/C2=N\NC4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: N-[(Z)-[5-(4-chlorophenyl)imino-1,3-diphenyl-pyrazol-4-ylidene]amino]aniline
CAS Name: N-[(Z)-[5-(4-chlorophenyl)imino-1,3-diphenyl-4-pyrazolylidene]amino]aniline
IUPAC NAME: N-[(Z)-[5-(4-chlorophenyl)imino-1,3-diphenylpyrazol-4-ylidene]amino]aniline
SYSTEMATIC NAME: N-[(Z)-[5-(4-chlorophenyl)imino-1,3-diphenyl-pyrazol-4-ylidene]amino]aniline
MOLECULAR FORMULA: C27H20ClN5
MOLECULAR WEIGHT: 449.9342
SMILES: C1=CC=C(C=C1)C\2=NN(C(=NC3=CC=C(C=C3)Cl)/C2=N\NC4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: N-[(Z)-[3-methyl-1-phenyl-5-(p-tolylimino)pyrazol-4-ylidene]amino]aniline
CAS Name: N-[(Z)-[3-methyl-5-(4-methylphenyl)imino-1-phenyl-4-pyrazolylidene]amino]aniline
IUPAC NAME: N-[(Z)-[3-methyl-5-(4-methylphenyl)imino-1-phenylpyrazol-4-ylidene]amino]aniline
SYSTEMATIC NAME: N-[(Z)-[3-methyl-5-(4-methylphenyl)imino-1-phenyl-pyrazol-4-ylidene]amino]aniline
MOLECULAR FORMULA: C23H21N5
MOLECULAR WEIGHT: 367.44634
SMILES: CC1=CC=C(C=C1)N=C2/C(=N\NC3=CC=CC=C3)/C(=NN2C4=CC=CC=C4)C
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Product OPENEYE NAME: N-[(Z)-(5-benzylimino-3-methyl-1-phenyl-pyrazol-4-ylidene)amino]aniline
CAS Name: N-[(Z)-[3-methyl-1-phenyl-5-(phenylmethyl)imino-4-pyrazolylidene]amino]aniline
IUPAC NAME: N-[(Z)-(5-benzylimino-3-methyl-1-phenylpyrazol-4-ylidene)amino]aniline
SYSTEMATIC NAME: N-[(Z)-[3-methyl-1-phenyl-5-(phenylmethyl)imino-pyrazol-4-ylidene]amino]aniline
MOLECULAR FORMULA: C23H21N5
MOLECULAR WEIGHT: 367.44634
SMILES: CC\1=NN(C(=NCC2=CC=CC=C2)/C1=N\NC3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: methyl 2-[[(4Z)-5-methyl-2-phenyl-4-(phenylhydrazono)pyrazol-3-ylidene]amino]benzoate
CAS Name: 2-[[(4Z)-5-methyl-2-phenyl-4-(phenylhydrazinylidene)-3-pyrazolylidene]amino]benzoic acid methyl ester
IUPAC NAME: methyl 2-[[(4Z)-5-methyl-2-phenyl-4-(phenylhydrazinylidene)pyrazol-3-ylidene]amino]benzoate
SYSTEMATIC NAME: methyl 2-[[(4Z)-5-methyl-2-phenyl-4-(phenylhydrazinylidene)pyrazol-3-ylidene]amino]benzoate
MOLECULAR FORMULA: C24H21N5O2
MOLECULAR WEIGHT: 411.45584
SMILES: CC\1=NN(C(=NC2=CC=CC=C2C(=O)OC)/C1=N\NC3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: N-[(Z)-(3-methyl-1-phenyl-5-phenylimino-pyrazol-4-ylidene)amino]aniline
CAS Name: N-[(Z)-(3-methyl-1-phenyl-5-phenylimino-4-pyrazolylidene)amino]aniline
IUPAC NAME: N-[(Z)-(3-methyl-1-phenyl-5-phenyliminopyrazol-4-ylidene)amino]aniline
SYSTEMATIC NAME: N-[(Z)-(3-methyl-1-phenyl-5-phenylimino-pyrazol-4-ylidene)amino]aniline
MOLECULAR FORMULA: C22H19N5
MOLECULAR WEIGHT: 353.41976
SMILES: CC\1=NN(C(=NC2=CC=CC=C2)/C1=N\NC3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: N-[(Z)-[5-(4-chlorophenyl)imino-3-methyl-1-phenyl-pyrazol-4-ylidene]amino]aniline
CAS Name: N-[(Z)-[5-(4-chlorophenyl)imino-3-methyl-1-phenyl-4-pyrazolylidene]amino]aniline
IUPAC NAME: N-[(Z)-[5-(4-chlorophenyl)imino-3-methyl-1-phenylpyrazol-4-ylidene]amino]aniline
SYSTEMATIC NAME: N-[(Z)-[5-(4-chlorophenyl)imino-3-methyl-1-phenyl-pyrazol-4-ylidene]amino]aniline
MOLECULAR FORMULA: C22H18ClN5
MOLECULAR WEIGHT: 387.86482
SMILES: CC\1=NN(C(=NC2=CC=C(C=C2)Cl)/C1=N\NC3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: N-[(Z)-[1,3-diphenyl-5-(p-tolylimino)pyrazol-4-ylidene]amino]aniline
CAS Name: N-[(Z)-[5-(4-methylphenyl)imino-1,3-diphenyl-4-pyrazolylidene]amino]aniline
IUPAC NAME: N-[(Z)-[5-(4-methylphenyl)imino-1,3-diphenylpyrazol-4-ylidene]amino]aniline
SYSTEMATIC NAME: N-[(Z)-[5-(4-methylphenyl)imino-1,3-diphenyl-pyrazol-4-ylidene]amino]aniline
MOLECULAR FORMULA: C28H23N5
MOLECULAR WEIGHT: 429.51572
SMILES: CC1=CC=C(C=C1)N=C2/C(=N\NC3=CC=CC=C3)/C(=NN2C4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: methyl 2-[[(4Z)-2,5-diphenyl-4-(phenylhydrazono)pyrazol-3-ylidene]amino]benzoate
CAS Name: 2-[[(4Z)-2,5-diphenyl-4-(phenylhydrazinylidene)-3-pyrazolylidene]amino]benzoic acid methyl ester
IUPAC NAME: methyl 2-[[(4Z)-2,5-diphenyl-4-(phenylhydrazinylidene)pyrazol-3-ylidene]amino]benzoate
SYSTEMATIC NAME: methyl 2-[[(4Z)-2,5-diphenyl-4-(phenylhydrazinylidene)pyrazol-3-ylidene]amino]benzoate
MOLECULAR FORMULA: C29H23N5O2
MOLECULAR WEIGHT: 473.52522
SMILES: COC(=O)C1=CC=CC=C1N=C2/C(=N\NC3=CC=CC=C3)/C(=NN2C4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: (4R,5R)-3-methyl-5-phenyl-4,5-dihydroisoxazole-4-carbaldehyde
CAS Name: (4R,5R)-3-methyl-5-phenyl-4,5-dihydroisoxazole-4-carboxaldehyde
IUPAC NAME: (4R,5R)-3-methyl-5-phenyl-4,5-dihydro-1,2-oxazole-4-carbaldehyde
SYSTEMATIC NAME: (4R,5R)-3-methyl-5-phenyl-4,5-dihydro-1,2-oxazole-4-carbaldehyde
MOLECULAR FORMULA: C11H11NO2
MOLECULAR WEIGHT: 189.21054
SMILES: CC1=NO[C@H]([C@@H]1C=O)C2=CC=CC=C2
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