4-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 3-nitro-4-[1-(o-tolyl)tetrazol-5-yl]sulfanyl-N-phenyl-benzenesulfonamide CAS Name: 4-[[1-(2-methylphenyl)-5-tetrazolyl]thio]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[1-(2-methylphenyl)tetrazol-5-yl]sulfanyl-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 3-nitro-4-[[1-(o-tolyl)tetrazol-5-yl]thio]-N-phenyl-benzenesulfonamide Formula: C20H16N6O4S2 MolecularWeight: 468.50884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O4S2/c1-14-7-5-6-10-17(14)25-20(21-23-24-25)31-19-12-11-16(13-18(19)26(27)28)32(29,30)22-15-8-3-2-4-9-15/h2-13,22H,1H3