[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl] 6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl] 6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [4-[methyl(p-tolylsulfonyl)amino]phenyl] 6-oxo-1H-pyridine-3-carboxylate CAS Name: 6-oxo-1H-pyridine-3-carboxylic acid [4-[methyl-(4-methylphenyl)sulfonylamino]phenyl] ester IUPAC Name: [4-[methyl-(4-methylphenyl)sulfonylamino]phenyl] 6-oxo-1H-pyridine-3-carboxylate Traditional Name: 6-keto-1H-pyridine-3-carboxylic acid [4-[methyl(tosyl)amino]phenyl] ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CNC(=O)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C20H18N2O5S/c1-14-3-10-18(11-4-14)28(25,26)22(2)16-6-8-17(9-7-16)27-20(24)15-5-12-19(23)21-13-15/h3-13H,1-2H3,(H,21,23)