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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=C(C=C(C=C3)CC(=O)CS(=O)(=O)N)SC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=C(C=C(C=C3)CC(=O)CS(=O)(=O)N)SC(F)(F)F

InChI

InChI=1S/C20H17F3N2O4S2/c21-20(22,23)30-19-10-13(9-16(26)12-31(24,27)28)5-8-18(19)29-11-15-7-6-14-3-1-2-4-17(14)25-15/h1-8,10H,9,11-12H2,(H2,24,27,28)