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

Systemtic Name: N-[(2R)-4-phenylbutan-2-yl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[(2R)-4-phenylbutan-2-yl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-[(2R)-4-phenylbutan-2-yl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C21H20F3N3OS MolecularWeight: 419.46321

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C21H20F3N3OS/c1-14(11-12-15-7-3-2-4-8-15)25-18(28)13-29-19-16-9-5-6-10-17(16)26-20(27-19)21(22,23)24/h2-10,14H,11-13H2,1H3,(H,25,28)/t14-/m1/s1