4-methyl-3-nitro-N-[4-[(pyridin-3-ylcarbonylamino)carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[4-[(pyridin-3-ylcarbonylamino)carbamoyl]phenyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[4-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[4-(nicotinamidocarbamoyl)phenyl]-3-nitro-benzenesulfonamide Formula: C20H17N5O6S MolecularWeight: 455.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O6S/c1-13-4-9-17(11-18(13)25(28)29)32(30,31)24-16-7-5-14(6-8-16)19(26)22-23-20(27)15-3-2-10-21-12-15/h2-12,24H,1H3,(H,22,26)(H,23,27)