1-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyridin-3-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyridin-3-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-(2,2,2-trifluoroethylsulfanyl)pyridine-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[oxo-[2-(2,2,2-trifluoroethylthio)-3-pyridinyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(2,2,2-trifluoroethylsulfanyl)pyridine-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[2-(2,2,2-trifluoroethylthio)nicotinoyl]isonipecotamide Formula: C14H16F3N3O2S MolecularWeight: 347.35595

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=C(N=CC=C2)SCC(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=C(N=CC=C2)SCC(F)(F)F

InChI

InChI=1S/C14H16F3N3O2S/c15-14(16,17)8-23-12-10(2-1-5-19-12)13(22)20-6-3-9(4-7-20)11(18)21/h1-2,5,9H,3-4,6-8H2,(H2,18,21)