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

Systemtic Name: 2-[(2-cyanopyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethyloxy)phenyl]pyridine-3-carboxamide Openeye Name: 2-[(2-cyano-4-pyridyl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide CAS Name: 2-[(2-cyano-4-pyridinyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2-cyanopyridin-4-yl)methylsulfanyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide Traditional Name: 2-[(2-cyano-4-pyridyl)methylthio]-N-[4-(trifluoromethoxy)phenyl]nicotinamide Formula: C20H13F3N4O2S MolecularWeight: 430.40303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13F3N4O2S/c21-20(22,23)29-16-5-3-14(4-6-16)27-18(28)17-2-1-8-26-19(17)30-12-13-7-9-25-15(10-13)11-24/h1-10H,12H2,(H,27,28)