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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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