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

Systemtic Name: 4-[4-(4-methylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-bis(phenylmethyl)benzenesulfonamide Openeye Name: N,N-dibenzyl-4-[5-methylsulfanyl-4-(p-tolyl)-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: 4-[4-(4-methylphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-N,N-bis(phenylmethyl)benzenesulfonamide IUPAC Name: N,N-dibenzyl-4-[4-(4-methylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-dibenzyl-4-[5-(methylthio)-4-(p-tolyl)-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C30H28N4O2S2 MolecularWeight: 540.69892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC)C3=CC=C(C=C3)S(=O)(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC)C3=CC=C(C=C3)S(=O)(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C30H28N4O2S2/c1-23-13-17-27(18-14-23)34-29(31-32-30(34)37-2)26-15-19-28(20-16-26)38(35,36)33(21-24-9-5-3-6-10-24)22-25-11-7-4-8-12-25/h3-20H,21-22H2,1-2H3