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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-N-(pyridin-3-ylmethyl)quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(3-pyridylmethyl)quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-N-(3-pyridinylmethyl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-3-ylmethyl)quinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazino)-N-(3-pyridylmethyl)quinoline-3-carboxamide Formula: C23H26FN5O2 MolecularWeight: 423.483243

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C23H26FN5O2/c1-3-28-15-18(23(31)26-14-16-5-4-6-25-13-16)22(30)17-11-19(24)21(12-20(17)28)29-9-7-27(2)8-10-29/h4-6,11-13,15H,3,7-10,14H2,1-2H3,(H,26,31)