N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C25H26N4OS2 MolecularWeight: 462.63014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C(=NNC3=S)C4=CC(=CC=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C(=NNC3=S)C4=CC(=CC=C4)C

InChI

InChI=1S/C25H26N4OS2/c1-3-18-9-11-19(12-10-18)23(21-8-5-15-32-21)26-22(30)13-14-29-24(27-28-25(29)31)20-7-4-6-17(2)16-20/h4-12,15-16,23H,3,13-14H2,1-2H3,(H,26,30)(H,28,31)