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

Systemtic Name: N-pentyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-pentyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-pentyl-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-pentyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-amyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C16H18F3N3OS MolecularWeight: 357.39383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NC(=NC2=CC=CC=C21)C(F)(F)F

Isomeric SMILES

CCCCCNC(=O)CSC1=NC(=NC2=CC=CC=C21)C(F)(F)F

InChI

InChI=1S/C16H18F3N3OS/c1-2-3-6-9-20-13(23)10-24-14-11-7-4-5-8-12(11)21-15(22-14)16(17,18)19/h4-5,7-8H,2-3,6,9-10H2,1H3,(H,20,23)