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

Systemtic Name: N-(2-thiophen-2-ylethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-[2-(2-thienyl)ethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-thiophen-2-ylethyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-thiophen-2-ylethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[2-(2-thienyl)ethyl]-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C17H14F3N3OS2 MolecularWeight: 397.43777

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)NCCC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C17H14F3N3OS2/c18-17(19,20)16-22-13-6-2-1-5-12(13)15(23-16)26-10-14(24)21-8-7-11-4-3-9-25-11/h1-6,9H,7-8,10H2,(H,21,24)