N-(3,4-dimethylphenyl)-4-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide Openeye Name: N-(3,4-dimethylphenyl)-4-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide CAS Name: N-(3,4-dimethylphenyl)-4-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(3,4-dimethylphenyl)-4-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide Traditional Name: N-(3,4-dimethylphenyl)-4-(nicotinamidocarbamoyl)benzenesulfonamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CN=CC=C3)C

InChI

InChI=1S/C21H20N4O4S/c1-14-5-8-18(12-15(14)2)25-30(28,29)19-9-6-16(7-10-19)20(26)23-24-21(27)17-4-3-11-22-13-17/h3-13,25H,1-2H3,(H,23,26)(H,24,27)