N-[[2-butoxy-6-(trifluoromethyl)pyridin-3-yl]methyl]-2-[3-fluoranyl-4-(methylsulfonylamino)phenyl]propanamide

Systemtic Name: N-[[2-butoxy-6-(trifluoromethyl)pyridin-3-yl]methyl]-2-[3-fluoranyl-4-(methylsulfonylamino)phenyl]propanamide Openeye Name: N-[[2-butoxy-6-(trifluoromethyl)-3-pyridyl]methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide CAS Name: N-[[2-butoxy-6-(trifluoromethyl)-3-pyridinyl]methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide IUPAC Name: N-[[2-butoxy-6-(trifluoromethyl)pyridin-3-yl]methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide Traditional Name: N-[[2-butoxy-6-(trifluoromethyl)-3-pyridyl]methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propionamide Formula: C21H25F4N3O4S MolecularWeight: 491.499513

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=N1)C(F)(F)F)CNC(=O)C(C)C2=CC(=C(C=C2)NS(=O)(=O)C)F

Isomeric SMILES

CCCCOC1=C(C=CC(=N1)C(F)(F)F)CNC(=O)C(C)C2=CC(=C(C=C2)NS(=O)(=O)C)F

InChI

InChI=1S/C21H25F4N3O4S/c1-4-5-10-32-20-15(7-9-18(27-20)21(23,24)25)12-26-19(29)13(2)14-6-8-17(16(22)11-14)28-33(3,30)31/h6-9,11,13,28H,4-5,10,12H2,1-3H3,(H,26,29)