1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-(6-pyrazol-1-ylpyridin-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-(6-pyrazol-1-ylpyridin-3-yl)piperidine-4-carboxamide Openeye Name: 1-(2,5-difluorophenyl)sulfonyl-N-(6-pyrazol-1-yl-3-pyridyl)piperidine-4-carboxamide CAS Name: 1-(2,5-difluorophenyl)sulfonyl-N-[6-(1-pyrazolyl)-3-pyridinyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,5-difluorophenyl)sulfonyl-N-(6-pyrazol-1-ylpyridin-3-yl)piperidine-4-carboxamide Traditional Name: 1-(2,5-difluorophenyl)sulfonyl-N-(6-pyrazol-1-yl-3-pyridyl)isonipecotamide Formula: C20H19F2N5O3S MolecularWeight: 447.458366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19F2N5O3S/c21-15-2-4-17(22)18(12-15)31(29,30)26-10-6-14(7-11-26)20(28)25-16-3-5-19(23-13-16)27-9-1-8-24-27/h1-5,8-9,12-14H,6-7,10-11H2,(H,25,28)