2-[[4,5-bis(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[4,5-bis(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[[4,5-bis(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H18N4OS MolecularWeight: 338.42672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)N

InChI

InChI=1S/C18H18N4OS/c19-16(23)13-24-18-21-20-17(11-14-7-3-1-4-8-14)22(18)12-15-9-5-2-6-10-15/h1-10H,11-13H2,(H2,19,23)