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

Systemtic Name: methyl 2-[[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoyl]amino]acetate CAS Name: 2-[[[3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]benzoyl]amino]acetate Traditional Name: 2-[[3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]benzoyl]amino]acetic acid methyl ester Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O6S/c1-14-19(21(28)25(24(14)2)16-9-5-4-6-10-16)23-32(29,30)17-11-7-8-15(12-17)20(27)22-13-18(26)31-3/h4-12,23H,13H2,1-3H3,(H,22,27)