(2S)-N,N-diethyl-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: (2S)-N,N-diethyl-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: (2S)-N,N-diethyl-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: (2S)-N,N-diethyl-2-phenyl-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: (2S)-N,N-diethyl-2-phenyl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: (2S)-N,N-diethyl-2-phenyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C21H20F3N3OS MolecularWeight: 419.46321

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CCN(CC)C(=O)[C@H](C1=CC=CC=C1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C21H20F3N3OS/c1-3-27(4-2)19(28)17(14-10-6-5-7-11-14)29-18-15-12-8-9-13-16(15)25-20(26-18)21(22,23)24/h5-13,17H,3-4H2,1-2H3/t17-/m0/s1