2-methyl-N-(phenylmethyl)-5-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide

Systemtic Name: 2-methyl-N-(phenylmethyl)-5-[(pyridin-3-ylcarbonylamino)carbamoyl]benzenesulfonamide Openeye Name: N-benzyl-2-methyl-5-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide CAS Name: 2-methyl-5-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-2-methyl-5-[(pyridine-3-carbonylamino)carbamoyl]benzenesulfonamide Traditional Name: N-benzyl-2-methyl-5-(nicotinamidocarbamoyl)benzenesulfonamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CN=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CN=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20N4O4S/c1-15-9-10-17(20(26)24-25-21(27)18-8-5-11-22-14-18)12-19(15)30(28,29)23-13-16-6-3-2-4-7-16/h2-12,14,23H,13H2,1H3,(H,24,26)(H,25,27)