Wednesday, February 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H42ClN3O4
MOLECULAR WEIGHT: 580.15728
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2CCC5=CCCCC5)C(=O)NC6=CC(=C(C=C6)C)Cl
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MOLECULAR FORMULA: C31H35ClN4O4
MOLECULAR WEIGHT: 563.087
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2CC5=CN=CC=C5)C(=O)NC6=CC(=C(C=C6)C)Cl
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MOLECULAR FORMULA: C29H38ClN3O4
MOLECULAR WEIGHT: 528.08272
SMILES: CCC(C)N1C(C23C=CC(O2)C(C3C1=O)C(=O)NC4=CC(=C(C=C4)C)Cl)C(=O)NC5CCCC(C5C)C
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Product OPENEYE NAME:
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SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H38ClN3O4
MOLECULAR WEIGHT: 528.08272
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2C(C)(C)C)C(=O)NC5=CC(=C(C=C5)C)Cl
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C32H35Cl2N3O4
MOLECULAR WEIGHT: 596.544
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2CC5=CC=CC=C5Cl)C(=O)NC6=CC(=C(C=C6)C)Cl
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H35Cl2N3O4
MOLECULAR WEIGHT: 596.544
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2CC5=CC=C(C=C5)Cl)C(=O)NC6=CC(=C(C=C6)C)Cl
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MOLECULAR FORMULA: C32H42ClN3O4
MOLECULAR WEIGHT: 568.14658
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2C5CCCCCC5)C(=O)NC6=CC(=C(C=C6)C)Cl
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C33H38ClN3O4
MOLECULAR WEIGHT: 576.12552
SMILES: CC1CCCC(C1C)NC(=O)C2C34C=CC(O3)C(C4C(=O)N2CC5=CC=C(C=C5)C)C(=O)NC6=CC(=C(C=C6)C)Cl
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MOLECULAR FORMULA: C28H36ClN3O4
MOLECULAR WEIGHT: 514.05614
SMILES: CCCN1C(C23C=CC(O2)C(C3C1=O)C(=O)NC4=CC(=C(C=C4)C)Cl)C(=O)NC5CCCC(C5C)C
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Product OPENEYE NAME: [2-[[[2-(benzylamino)-2-oxo-acetyl]hydrazono]methyl]phenyl] 3-methylbenzoate
CAS Name: 3-methylbenzoic acid [2-[[[1,2-dioxo-2-[(phenylmethyl)amino]ethyl]hydrazinylidene]methyl]phenyl] ester
IUPAC NAME: [2-[[[2-(benzylamino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 3-methylbenzoate
SYSTEMATIC NAME: [2-[[[2-oxidanylidene-2-[(phenylmethyl)amino]ethanoyl]hydrazinylidene]methyl]phenyl] 3-methylbenzoate
MOLECULAR FORMULA: C24H21N3O4
MOLECULAR WEIGHT: 415.44124
SMILES: CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2C=NNC(=O)C(=O)NCC3=CC=CC=C3
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Product OPENEYE NAME: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea
CAS Name: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-1-(2-oxolanylmethyl)thiourea
IUPAC NAME: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea
SYSTEMATIC NAME: 3-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea
MOLECULAR FORMULA: C19H20Cl2N2OS
MOLECULAR WEIGHT: 395.3459
SMILES: C1CC(OC1)CN(CC2=CC=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-[(2-chlorophenyl)methyl]-1-(2-furylmethyl)-3-(4-methoxyphenyl)thiourea
CAS Name: 1-[(2-chlorophenyl)methyl]-1-(2-furanylmethyl)-3-(4-methoxyphenyl)thiourea
IUPAC NAME: 1-[(2-chlorophenyl)methyl]-1-(furan-2-ylmethyl)-3-(4-methoxyphenyl)thiourea
SYSTEMATIC NAME: 1-[(2-chlorophenyl)methyl]-1-(furan-2-ylmethyl)-3-(4-methoxyphenyl)thiourea
MOLECULAR FORMULA: C20H19ClN2O2S
MOLECULAR WEIGHT: 386.89506
SMILES: COC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2Cl)CC3=CC=CO3
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Product OPENEYE NAME: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-2,4-dimethoxy-benzamide
CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]-2,4-dimethoxybenzamide
IUPAC NAME: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2,4-dimethoxybenzamide
SYSTEMATIC NAME: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2,4-dimethoxy-benzamide
MOLECULAR FORMULA: C20H18N2O5S
MOLECULAR WEIGHT: 398.43232
SMILES: COC1=CC(=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4)OC
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Product OPENEYE NAME: N-(5-benzoyl-4-phenyl-thiazol-2-yl)-4-[benzyl(ethyl)sulfamoyl]benzamide
CAS Name: N-(5-benzoyl-4-phenyl-2-thiazolyl)-4-[ethyl-(phenylmethyl)sulfamoyl]benzamide
IUPAC NAME: N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)-4-[benzyl(ethyl)sulfamoyl]benzamide
SYSTEMATIC NAME: 4-[ethyl-(phenylmethyl)sulfamoyl]-N-[4-phenyl-5-(phenylcarbonyl)-1,3-thiazol-2-yl]benzamide
MOLECULAR FORMULA: C32H27N3O4S2
MOLECULAR WEIGHT: 581.70448
SMILES: CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=C(S3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5
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