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

Systemtic Name: N-[2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]ethanamide Openeye Name: N-[2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]acetamide CAS Name: N-[2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]ethyl]acetamide IUPAC Name: N-[2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]acetamide Traditional Name: N-[2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]acetamide Formula: C16H20N4OS MolecularWeight: 316.4212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSC1=NN=C(N1CC2=CC=CC=C2)C3CC3

Isomeric SMILES

CC(=O)NCCSC1=NN=C(N1CC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C16H20N4OS/c1-12(21)17-9-10-22-16-19-18-15(14-7-8-14)20(16)11-13-5-3-2-4-6-13/h2-6,14H,7-11H2,1H3,(H,17,21)