N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[3-(2-methyl-4-pyrimidinyl)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C19H16N6OS2 MolecularWeight: 408.49994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C19H16N6OS2/c1-12-20-8-7-15(21-12)13-4-2-5-14(10-13)22-17(26)11-25-18(23-24-19(25)27)16-6-3-9-28-16/h2-10H,11H2,1H3,(H,22,26)(H,24,27)