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

Systemtic Name: N-[2-(4-methylphenoxy)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[2-(4-methylphenoxy)phenyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[2-(4-methylphenoxy)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[2-(4-methylphenoxy)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[2-(4-methylphenoxy)phenyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C21H18N4O2S2/c1-14-8-10-15(11-9-14)27-17-6-3-2-5-16(17)22-19(26)13-25-20(23-24-21(25)28)18-7-4-12-29-18/h2-12H,13H2,1H3,(H,22,26)(H,24,28)