5-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]pentanamide

Systemtic Name: 5-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]pentanamide Openeye Name: 5-(isopropylsulfonylamino)-N-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethyl]pentanamide CAS Name: 5-(propan-2-ylsulfonylamino)-N-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethyl]pentanamide IUPAC Name: 5-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]pentanamide Traditional Name: 5-(isopropylsulfonylamino)-N-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethyl]valeramide Formula: C20H26F3N3O3S2 MolecularWeight: 477.56395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCCCCC(=O)NCCSC1=CC(=NC2=CC=CC=C21)C(F)(F)F

Isomeric SMILES

CC(C)S(=O)(=O)NCCCCC(=O)NCCSC1=CC(=NC2=CC=CC=C21)C(F)(F)F

InChI

InChI=1S/C20H26F3N3O3S2/c1-14(2)31(28,29)25-10-6-5-9-19(27)24-11-12-30-17-13-18(20(21,22)23)26-16-8-4-3-7-15(16)17/h3-4,7-8,13-14,25H,5-6,9-12H2,1-2H3,(H,24,27)