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

Systemtic Name: 2,5-dimethoxy-N-[[4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Openeye Name: 2,5-dimethoxy-N-[[5-methylsulfanyl-4-(o-tolyl)-1,2,4-triazol-3-yl]methyl]benzenesulfonamide CAS Name: 2,5-dimethoxy-N-[[4-(2-methylphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]benzenesulfonamide IUPAC Name: 2,5-dimethoxy-N-[[4-(2-methylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Traditional Name: 2,5-dimethoxy-N-[[5-(methylthio)-4-(o-tolyl)-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Formula: C19H22N4O4S2 MolecularWeight: 434.53238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O4S2/c1-13-7-5-6-8-15(13)23-18(21-22-19(23)28-4)12-20-29(24,25)17-11-14(26-2)9-10-16(17)27-3/h5-11,20H,12H2,1-4H3