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

Systemtic Name: 4-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]-N,N-bis(phenylmethyl)benzenesulfonamide Openeye Name: N,N-dibenzyl-4-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]benzenesulfonamide CAS Name: 4-[3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-4-yl]-N,N-bis(phenylmethyl)benzenesulfonamide IUPAC Name: N,N-dibenzyl-4-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-4-yl]benzenesulfonamide Traditional Name: N,N-dibenzyl-4-[3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C30H28N4O3S2 MolecularWeight: 556.69832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)S(=O)(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)S(=O)(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5)SC

InChI

InChI=1S/C30H28N4O3S2/c1-37-27-17-13-25(14-18-27)29-31-32-30(38-2)34(29)26-15-19-28(20-16-26)39(35,36)33(21-23-9-5-3-6-10-23)22-24-11-7-4-8-12-24/h3-20H,21-22H2,1-2H3