8-ethoxy-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]quinoline-5-sulfonamide

Systemtic Name: 8-ethoxy-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]quinoline-5-sulfonamide Openeye Name: 8-ethoxy-N-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethyl]quinoline-5-sulfonamide CAS Name: 8-ethoxy-N-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethyl]-5-quinolinesulfonamide IUPAC Name: 8-ethoxy-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]quinoline-5-sulfonamide Traditional Name: 8-ethoxy-N-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethyl]quinoline-5-sulfonamide Formula: C23H20F3N3O3S2 MolecularWeight: 507.54841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)NCCSC3=CC(=NC4=CC=CC=C43)C(F)(F)F)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)NCCSC3=CC(=NC4=CC=CC=C43)C(F)(F)F)C=CC=N2

InChI

InChI=1S/C23H20F3N3O3S2/c1-2-32-18-9-10-20(16-7-5-11-27-22(16)18)34(30,31)28-12-13-33-19-14-21(23(24,25)26)29-17-8-4-3-6-15(17)19/h3-11,14,28H,2,12-13H2,1H3