2-[6-methyl-2-(trifluoromethyl)quinolin-4-yl]sulfanylethylazanium

Systemtic Name: 2-[6-methyl-2-(trifluoromethyl)quinolin-4-yl]sulfanylethylazanium Openeye Name: 2-[[6-methyl-2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethylammonium CAS Name: 2-[[6-methyl-2-(trifluoromethyl)-4-quinolinyl]thio]ethylammonium IUPAC Name: 2-[6-methyl-2-(trifluoromethyl)quinolin-4-yl]sulfanylethylazanium Traditional Name: 2-[[6-methyl-2-(trifluoromethyl)-4-quinolyl]thio]ethylammonium Formula: C13H14F3N2S+ MolecularWeight: 287.32387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2SCC[NH3+])C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2SCC[NH3+])C(F)(F)F

InChI

InChI=1S/C13H13F3N2S/c1-8-2-3-10-9(6-8)11(19-5-4-17)7-12(18-10)13(14,15)16/h2-3,6-7H,4-5,17H2,1H3/p+1