N-(2-cyanoethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C14H11F3N4OS MolecularWeight: 340.32355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NCCC#N

InChI

InChI=1S/C14H11F3N4OS/c15-14(16,17)13-20-10-5-2-1-4-9(10)12(21-13)23-8-11(22)19-7-3-6-18/h1-2,4-5H,3,7-8H2,(H,19,22)