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

Systemtic Name: 4-[3-ethylsulfanyl-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-N,N-bis(phenylmethyl)benzenesulfonamide Openeye Name: N,N-dibenzyl-4-[3-ethylsulfanyl-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]benzenesulfonamide CAS Name: 4-[3-(ethylthio)-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-N,N-bis(phenylmethyl)benzenesulfonamide IUPAC Name: N,N-dibenzyl-4-[3-ethylsulfanyl-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]benzenesulfonamide Traditional Name: N,N-dibenzyl-4-[3-(ethylthio)-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C31H30N4O3S2 MolecularWeight: 570.7249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C5=CC=C(C=C5)OC

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C31H30N4O3S2/c1-3-39-31-33-32-30(26-14-18-28(38-2)19-15-26)35(31)27-16-20-29(21-17-27)40(36,37)34(22-24-10-6-4-7-11-24)23-25-12-8-5-9-13-25/h4-21H,3,22-23H2,1-2H3