3-methyl-N-[2-oxidanylidene-2-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethylamino]ethyl]butanamide

Systemtic Name: 3-methyl-N-[2-oxidanylidene-2-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethylamino]ethyl]butanamide Openeye Name: 3-methyl-N-[2-oxo-2-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethylamino]ethyl]butanamide CAS Name: 3-methyl-N-[2-oxo-2-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethylamino]ethyl]butanamide IUPAC Name: 3-methyl-N-[2-oxo-2-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethylamino]ethyl]butanamide Traditional Name: N-[2-keto-2-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethylamino]ethyl]-3-methyl-butyramide Formula: C19H22F3N3O2S MolecularWeight: 413.45709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCC(=O)NCCSC1=CC(=NC2=CC=CC=C21)C(F)(F)F

Isomeric SMILES

CC(C)CC(=O)NCC(=O)NCCSC1=CC(=NC2=CC=CC=C21)C(F)(F)F

InChI

InChI=1S/C19H22F3N3O2S/c1-12(2)9-17(26)24-11-18(27)23-7-8-28-15-10-16(19(20,21)22)25-14-6-4-3-5-13(14)15/h3-6,10,12H,7-9,11H2,1-2H3,(H,23,27)(H,24,26)