N-[6-methoxy-3-(4-methylsulfanylphenyl)-2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide

Systemtic Name: N-[6-methoxy-3-(4-methylsulfanylphenyl)-2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide Openeye Name: N-[6-methoxy-3-(4-methylsulfanylphenyl)-2-(trifluoromethyl)-4-pyridyl]benzenesulfonamide CAS Name: N-[6-methoxy-3-[4-(methylthio)phenyl]-2-(trifluoromethyl)-4-pyridinyl]benzenesulfonamide IUPAC Name: N-[6-methoxy-3-(4-methylsulfanylphenyl)-2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide Traditional Name: N-[6-methoxy-3-[4-(methylthio)phenyl]-2-(trifluoromethyl)-4-pyridyl]benzenesulfonamide Formula: C20H17F3N2O3S2 MolecularWeight: 454.48579

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C(=C1)NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)SC)C(F)(F)F

Isomeric SMILES

COC1=NC(=C(C(=C1)NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)SC)C(F)(F)F

InChI

InChI=1S/C20H17F3N2O3S2/c1-28-17-12-16(25-30(26,27)15-6-4-3-5-7-15)18(19(24-17)20(21,22)23)13-8-10-14(29-2)11-9-13/h3-12H,1-2H3,(H,24,25)