1-ethyl-6-fluoranyl-4-oxidanylidene-N-(pyridin-4-ylmethyl)-7-(4-quinolin-2-ylcarbonylpiperazin-1-yl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-N-(pyridin-4-ylmethyl)-7-(4-quinolin-2-ylcarbonylpiperazin-1-yl)quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-4-oxo-N-(4-pyridylmethyl)-7-[4-(quinoline-2-carbonyl)piperazin-1-yl]quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-[oxo(2-quinolinyl)methyl]-1-piperazinyl]-N-(pyridin-4-ylmethyl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-4-oxo-N-(pyridin-4-ylmethyl)-7-[4-(quinoline-2-carbonyl)piperazin-1-yl]quinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-4-keto-N-(4-pyridylmethyl)-7-(4-quinaldoylpiperazino)quinoline-3-carboxamide Formula: C32H29FN6O3 MolecularWeight: 564.609463

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=NC5=CC=CC=C5C=C4)F)C(=O)NCC6=CC=NC=C6

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=NC5=CC=CC=C5C=C4)F)C(=O)NCC6=CC=NC=C6

InChI

InChI=1S/C32H29FN6O3/c1-2-37-20-24(31(41)35-19-21-9-11-34-12-10-21)30(40)23-17-25(33)29(18-28(23)37)38-13-15-39(16-14-38)32(42)27-8-7-22-5-3-4-6-26(22)36-27/h3-12,17-18,20H,2,13-16,19H2,1H3,(H,35,41)