N-[(1R)-1-phenylethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-phenylethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-phenylethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[(1R)-1-phenylethyl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-[(1R)-1-phenylethyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-phenylethyl]-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C19H16F3N3OS MolecularWeight: 391.41005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C19H16F3N3OS/c1-12(13-7-3-2-4-8-13)23-16(26)11-27-17-14-9-5-6-10-15(14)24-18(25-17)19(20,21)22/h2-10,12H,11H2,1H3,(H,23,26)/t12-/m1/s1