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

Systemtic Name: N-methyl-4-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-[1-(p-tolyl)tetrazol-5-yl]sulfanyl-benzenesulfonamide CAS Name: N-methyl-4-[[1-(4-methylphenyl)-5-tetrazolyl]thio]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[1-(4-methylphenyl)tetrazol-5-yl]sulfanyl-3-nitrobenzenesulfonamide Traditional Name: N-methyl-3-nitro-4-[[1-(p-tolyl)tetrazol-5-yl]thio]benzenesulfonamide Formula: C15H14N6O4S2 MolecularWeight: 406.43946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O4S2/c1-10-3-5-11(6-4-10)20-15(17-18-19-20)26-14-8-7-12(27(24,25)16-2)9-13(14)21(22)23/h3-9,16H,1-2H3