N-[(4-fluoranyl-2-methylsulfonyl-phenyl)methyl]-6-[3-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[(4-fluoranyl-2-methylsulfonyl-phenyl)methyl]-6-[3-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide Openeye Name: N-[(4-fluoro-2-methylsulfonyl-phenyl)methyl]-6-[3-(trifluoromethoxy)phenyl]pyridine-3-carboxamide CAS Name: N-[(4-fluoro-2-methylsulfonylphenyl)methyl]-6-[3-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide IUPAC Name: N-[(4-fluoro-2-methylsulfonylphenyl)methyl]-6-[3-(trifluoromethoxy)phenyl]pyridine-3-carboxamide Traditional Name: N-(4-fluoro-2-mesyl-benzyl)-6-[3-(trifluoromethoxy)phenyl]nicotinamide Formula: C21H16F4N2O4S MolecularWeight: 468.421353

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)CNC(=O)C2=CN=C(C=C2)C3=CC(=CC=C3)OC(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)CNC(=O)C2=CN=C(C=C2)C3=CC(=CC=C3)OC(F)(F)F

InChI

InChI=1S/C21H16F4N2O4S/c1-32(29,30)19-10-16(22)7-5-14(19)11-27-20(28)15-6-8-18(26-12-15)13-3-2-4-17(9-13)31-21(23,24)25/h2-10,12H,11H2,1H3,(H,27,28)