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

Systemtic Name: methyl 4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoylmethyl]benzoate Openeye Name: methyl 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoylmethyl]benzoate CAS Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoylmethyl]benzoate Traditional Name: 4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoylmethyl]benzoic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21N3O5S/c1-14-18(19(24)23(22(14)2)17-7-5-4-6-8-17)21-29(26,27)13-15-9-11-16(12-10-15)20(25)28-3/h4-12,21H,13H2,1-3H3