2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-propyl-ethanamide

Systemtic Name: 2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]-N-propylacetamide IUPAC Name: 2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-propylacetamide Traditional Name: 2-[[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]thio]-N-propyl-acetamide Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC(=NC2=C1C=CC=C2C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)CSC1=NC(=NC2=C1C=CC=C2C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C20H18F3N3OS/c1-2-11-24-16(27)12-28-19-14-9-6-10-15(20(21,22)23)17(14)25-18(26-19)13-7-4-3-5-8-13/h3-10H,2,11-12H2,1H3,(H,24,27)