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

Systemtic Name: N-[[4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Openeye Name: N-[[5-methylsulfanyl-4-(o-tolyl)-1,2,4-triazol-3-yl]methyl]benzenesulfonamide CAS Name: N-[[4-(2-methylphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]benzenesulfonamide IUPAC Name: N-[[4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Traditional Name: N-[[5-(methylthio)-4-(o-tolyl)-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SC)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SC)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2S2/c1-13-8-6-7-11-15(13)21-16(19-20-17(21)24-2)12-18-25(22,23)14-9-4-3-5-10-14/h3-11,18H,12H2,1-2H3