6-[2,4-bis(fluoranyl)phenyl]-2-(piperidin-1-ylmethyl)-N-quinolin-6-yl-pyridine-3-carboxamide

Systemtic Name: 6-[2,4-bis(fluoranyl)phenyl]-2-(piperidin-1-ylmethyl)-N-quinolin-6-yl-pyridine-3-carboxamide Openeye Name: 6-(2,4-difluorophenyl)-2-(1-piperidylmethyl)-N-(6-quinolyl)pyridine-3-carboxamide CAS Name: 6-(2,4-difluorophenyl)-2-(1-piperidinylmethyl)-N-(6-quinolinyl)-3-pyridinecarboxamide IUPAC Name: 6-(2,4-difluorophenyl)-2-(piperidin-1-ylmethyl)-N-quinolin-6-ylpyridine-3-carboxamide Traditional Name: 6-(2,4-difluorophenyl)-2-(piperidinomethyl)-N-(6-quinolyl)nicotinamide Formula: C27H24F2N4O MolecularWeight: 458.502466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C=CC(=N2)C3=C(C=C(C=C3)F)F)C(=O)NC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C1CCN(CC1)CC2=C(C=CC(=N2)C3=C(C=C(C=C3)F)F)C(=O)NC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C27H24F2N4O/c28-19-6-8-21(23(29)16-19)25-11-9-22(26(32-25)17-33-13-2-1-3-14-33)27(34)31-20-7-10-24-18(15-20)5-4-12-30-24/h4-12,15-16H,1-3,13-14,17H2,(H,31,34)