1-(4-fluorophenyl)-4-oxidanylidene-N-(piperidin-1-ylmethyl)-7-pyridin-4-yl-quinoline-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-4-oxidanylidene-N-(piperidin-1-ylmethyl)-7-pyridin-4-yl-quinoline-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-4-oxo-N-(1-piperidylmethyl)-7-(4-pyridyl)quinoline-3-carboxamide CAS Name: 1-(4-fluorophenyl)-4-oxo-N-(1-piperidinylmethyl)-7-pyridin-4-yl-3-quinolinecarboxamide IUPAC Name: 1-(4-fluorophenyl)-4-oxo-N-(piperidin-1-ylmethyl)-7-pyridin-4-ylquinoline-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-4-keto-N-(piperidinomethyl)-7-(4-pyridyl)quinoline-3-carboxamide Formula: C27H25FN4O2 MolecularWeight: 456.511403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CNC(=O)C2=CN(C3=C(C2=O)C=CC(=C3)C4=CC=NC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(CC1)CNC(=O)C2=CN(C3=C(C2=O)C=CC(=C3)C4=CC=NC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H25FN4O2/c28-21-5-7-22(8-6-21)32-17-24(27(34)30-18-31-14-2-1-3-15-31)26(33)23-9-4-20(16-25(23)32)19-10-12-29-13-11-19/h4-13,16-17H,1-3,14-15,18H2,(H,30,34)