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

Systemtic Name: N-[2-(2-methylphenyl)ethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-[2-(o-tolyl)ethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[2-(2-methylphenyl)ethyl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-[2-(2-methylphenyl)ethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[2-(o-tolyl)ethyl]-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C20H18F3N3OS/c1-13-6-2-3-7-14(13)10-11-24-17(27)12-28-18-15-8-4-5-9-16(15)25-19(26-18)20(21,22)23/h2-9H,10-12H2,1H3,(H,24,27)