N-(2-tert-butylsulfanylethyl)-1-methyl-2-oxidanylidene-4-(trifluoromethyl)quinoline-6-sulfonamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-1-methyl-2-oxidanylidene-4-(trifluoromethyl)quinoline-6-sulfonamide Openeye Name: N-(2-tert-butylsulfanylethyl)-1-methyl-2-oxo-4-(trifluoromethyl)quinoline-6-sulfonamide CAS Name: N-[2-(tert-butylthio)ethyl]-1-methyl-2-oxo-4-(trifluoromethyl)-6-quinolinesulfonamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-1-methyl-2-oxo-4-(trifluoromethyl)quinoline-6-sulfonamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-keto-1-methyl-4-(trifluoromethyl)quinoline-6-sulfonamide Formula: C17H21F3N2O3S2 MolecularWeight: 422.48545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)C=C2C(F)(F)F)C

Isomeric SMILES

CC(C)(C)SCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)C=C2C(F)(F)F)C

InChI

InChI=1S/C17H21F3N2O3S2/c1-16(2,3)26-8-7-21-27(24,25)11-5-6-14-12(9-11)13(17(18,19)20)10-15(23)22(14)4/h5-6,9-10,21H,7-8H2,1-4H3