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

Systemtic Name: 2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: 2-[[2-phenyl-8-(trifluoromethyl)-4-quinazolinyl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]sulfanyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[2-phenyl-8-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C20H16F3N3OS MolecularWeight: 403.42075

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16F3N3OS/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/h2-10H,1,11-12H2,(H,24,27)