2-oxidanylidene-N-[4-(quinolin-2-ylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]propane-1-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[4-(quinolin-2-ylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]propane-1-sulfonamide Openeye Name: 2-oxo-N-[4-(2-quinolylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]propane-1-sulfonamide CAS Name: 2-oxo-N-[4-(2-quinolinylmethoxy)-3-(trifluoromethylthio)phenyl]-1-propanesulfonamide IUPAC Name: 2-oxo-N-[4-(quinolin-2-ylmethoxy)-3-(trifluoromethylsulfanyl)phenyl]propane-1-sulfonamide Traditional Name: 2-keto-N-[4-(2-quinolylmethoxy)-3-(trifluoromethylthio)phenyl]propane-1-sulfonamide Formula: C20H17F3N2O4S2 MolecularWeight: 470.48519

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CS(=O)(=O)NC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)SC(F)(F)F

Isomeric SMILES

CC(=O)CS(=O)(=O)NC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)SC(F)(F)F

InChI

InChI=1S/C20H17F3N2O4S2/c1-13(26)12-31(27,28)25-15-8-9-18(19(10-15)30-20(21,22)23)29-11-16-7-6-14-4-2-3-5-17(14)24-16/h2-10,25H,11-12H2,1H3