N,N-dimethyl-3-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[[4-(o-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide Traditional Name: N,N-dimethyl-3-[[[4-(o-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]benzenesulfonamide Formula: C23H23N5O2S2 MolecularWeight: 465.59102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC(=CC=C3)S(=O)(=O)N(C)C)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC(=CC=C3)S(=O)(=O)N(C)C)C4=CC=NC=C4

InChI

InChI=1S/C23H23N5O2S2/c1-17-7-4-5-10-21(17)28-22(19-11-13-24-14-12-19)25-26-23(28)31-16-18-8-6-9-20(15-18)32(29,30)27(2)3/h4-15H,16H2,1-3H3