N-(2-ethyl-6-methyl-phenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F)C

InChI

InChI=1S/C20H18F3N3OS/c1-3-13-8-6-7-12(2)17(13)25-16(27)11-28-18-14-9-4-5-10-15(14)24-19(26-18)20(21,22)23/h4-10H,3,11H2,1-2H3,(H,25,27)