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

Systemtic Name: 2-[[4,5-bis(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butyl-ethanamide Openeye Name: N-tert-butyl-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]-N-tert-butylacetamide IUPAC Name: N-tert-butyl-2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-tert-butyl-2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N4OS/c1-22(2,3)23-20(27)16-28-21-25-24-19(14-17-10-6-4-7-11-17)26(21)15-18-12-8-5-9-13-18/h4-13H,14-16H2,1-3H3,(H,23,27)