3-chloranyl-4-methyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-4-methyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide Openeye Name: 3-chloro-4-methyl-N-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethyl]benzenesulfonamide CAS Name: 3-chloro-4-methyl-N-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethyl]benzenesulfonamide IUPAC Name: 3-chloro-4-methyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide Traditional Name: 3-chloro-4-methyl-N-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethyl]benzenesulfonamide Formula: C19H16ClF3N2O2S2 MolecularWeight: 460.92075

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCSC2=CC(=NC3=CC=CC=C32)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCSC2=CC(=NC3=CC=CC=C32)C(F)(F)F)Cl

InChI

InChI=1S/C19H16ClF3N2O2S2/c1-12-6-7-13(10-15(12)20)29(26,27)24-8-9-28-17-11-18(19(21,22)23)25-16-5-3-2-4-14(16)17/h2-7,10-11,24H,8-9H2,1H3