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

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-benzyl-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C13H16N4OS/c1-10-15-16-13(17(10)2)19-9-12(18)14-8-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,14,18)