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

Systemtic Name: N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-nitro-benzenesulfonamide Openeye Name: 2-nitro-N-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]benzenesulfonamide CAS Name: N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-nitrobenzenesulfonamide Traditional Name: 2-nitro-N-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]benzenesulfonamide Formula: C16H14N4O5S MolecularWeight: 374.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O5S/c1-11-6-8-12(9-7-11)16-18-15(25-19-16)10-17-26(23,24)14-5-3-2-4-13(14)20(21)22/h2-9,17H,10H2,1H3