4-iodanyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide

Systemtic Name: 4-iodanyl-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide Openeye Name: 4-iodo-N-[2-[[2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethyl]benzenesulfonamide CAS Name: 4-iodo-N-[2-[[2-(trifluoromethyl)-4-quinolinyl]thio]ethyl]benzenesulfonamide IUPAC Name: 4-iodo-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]benzenesulfonamide Traditional Name: 4-iodo-N-[2-[[2-(trifluoromethyl)-4-quinolyl]thio]ethyl]benzenesulfonamide Formula: C18H14F3IN2O2S2 MolecularWeight: 538.34564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)SCCNS(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)SCCNS(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C18H14F3IN2O2S2/c19-18(20,21)17-11-16(14-3-1-2-4-15(14)24-17)27-10-9-23-28(25,26)13-7-5-12(22)6-8-13/h1-8,11,23H,9-10H2