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

Systemtic Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]ethanamide Openeye Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide IUPAC Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]acetamide Traditional Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C20H14N4OS3 MolecularWeight: 422.54636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CN2C(=NNC2=S)C3=CC=CS3)C#CC4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CN2C(=NNC2=S)C3=CC=CS3)C#CC4=CC=CS4

InChI

InChI=1S/C20H14N4OS3/c25-18(13-24-19(22-23-20(24)26)17-7-3-11-28-17)21-15-5-1-4-14(12-15)8-9-16-6-2-10-27-16/h1-7,10-12H,13H2,(H,21,25)(H,23,26)