1-[2,4-bis(fluoranyl)phenyl]carbonyl-N-(2-pyrazol-1-ylpyridin-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]carbonyl-N-(2-pyrazol-1-ylpyridin-3-yl)piperidine-4-carboxamide Openeye Name: 1-(2,4-difluorobenzoyl)-N-(2-pyrazol-1-yl-3-pyridyl)piperidine-4-carboxamide CAS Name: 1-[(2,4-difluorophenyl)-oxomethyl]-N-[2-(1-pyrazolyl)-3-pyridinyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-difluorobenzoyl)-N-(2-pyrazol-1-ylpyridin-3-yl)piperidine-4-carboxamide Traditional Name: 1-(2,4-difluorobenzoyl)-N-(2-pyrazol-1-yl-3-pyridyl)isonipecotamide Formula: C21H19F2N5O2 MolecularWeight: 411.404666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(N=CC=C2)N3C=CC=N3)C(=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(N=CC=C2)N3C=CC=N3)C(=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C21H19F2N5O2/c22-15-4-5-16(17(23)13-15)21(30)27-11-6-14(7-12-27)20(29)26-18-3-1-8-24-19(18)28-10-2-9-25-28/h1-5,8-10,13-14H,6-7,11-12H2,(H,26,29)