2-[(2-fluoranylpyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-[(2-fluoranylpyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(2-fluoro-4-pyridyl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide CAS Name: 2-[(2-fluoro-4-pyridinyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2-fluoropyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(2-fluoro-4-pyridyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]nicotinamide Formula: C19H13F4N3O2S MolecularWeight: 423.384033

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC(=NC=C2)F)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC(=NC=C2)F)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H13F4N3O2S/c20-16-10-12(7-9-24-16)11-29-18-15(2-1-8-25-18)17(27)26-13-3-5-14(6-4-13)28-19(21,22)23/h1-10H,11H2,(H,26,27)