(4-methoxycarbonylphenyl)methyl 5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]-2-methyl-benzoate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]-2-methyl-benzoate Openeye Name: (4-methoxycarbonylphenyl)methyl 5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]-2-methylbenzoic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 5-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]-2-methylbenzoate Traditional Name: 5-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]-2-methyl-benzoic acid (4-carbomethoxybenzyl) ester Formula: C28H27N3O7S MolecularWeight: 549.59488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=O)OCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=O)OCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H27N3O7S/c1-18-10-15-23(16-24(18)28(34)38-17-20-11-13-21(14-12-20)27(33)37-4)39(35,36)29-25-19(2)30(3)31(26(25)32)22-8-6-5-7-9-22/h5-16,29H,17H2,1-4H3