2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-thiazol-2-yl-acetamide CAS Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-thiazol-2-yl-acetamide Formula: C14H13N5OS2 MolecularWeight: 331.41592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NC3=NC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NC3=NC=CS3

InChI

InChI=1S/C14H13N5OS2/c1-9-2-4-10(5-3-9)12-17-18-14(21)19(12)8-11(20)16-13-15-6-7-22-13/h2-7H,8H2,1H3,(H,18,21)(H,15,16,20)