N-[(2-methylsulfanylphenyl)methyl]-4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide

Systemtic Name: N-[(2-methylsulfanylphenyl)methyl]-4-[[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Openeye Name: N-[(2-methylsulfanylphenyl)methyl]-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide CAS Name: N-[[2-(methylthio)phenyl]methyl]-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide IUPAC Name: N-[(2-methylsulfanylphenyl)methyl]-4-[[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]benzenesulfonamide Traditional Name: 4-[[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]methyl]-N-[2-(methylthio)benzyl]benzenesulfonamide Formula: C25H21F3N2O3S2 MolecularWeight: 518.57105

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1CNS(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

Isomeric SMILES

CSC1=CC=CC=C1CNS(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)NC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C25H21F3N2O3S2/c1-34-23-5-3-2-4-18(23)15-29-35(32,33)19-9-6-16(7-10-19)12-17-8-11-22-20(13-17)21(25(26,27)28)14-24(31)30-22/h2-11,13-14,29H,12,15H2,1H3,(H,30,31)