N-[3-(4-fluorophenyl)-6-propoxy-2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide

Systemtic Name: N-[3-(4-fluorophenyl)-6-propoxy-2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide Openeye Name: N-[3-(4-fluorophenyl)-6-propoxy-2-(trifluoromethyl)-4-pyridyl]benzenesulfonamide CAS Name: N-[3-(4-fluorophenyl)-6-propoxy-2-(trifluoromethyl)-4-pyridinyl]benzenesulfonamide IUPAC Name: N-[3-(4-fluorophenyl)-6-propoxy-2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide Traditional Name: N-[3-(4-fluorophenyl)-6-propoxy-2-(trifluoromethyl)-4-pyridyl]benzenesulfonamide Formula: C21H18F4N2O3S MolecularWeight: 454.437833

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=C(C(=C1)NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)F)C(F)(F)F

Isomeric SMILES

CCCOC1=NC(=C(C(=C1)NS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C21H18F4N2O3S/c1-2-12-30-18-13-17(27-31(28,29)16-6-4-3-5-7-16)19(20(26-18)21(23,24)25)14-8-10-15(22)11-9-14/h3-11,13H,2,12H2,1H3,(H,26,27)