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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(2-pyridylmethyl)quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-N-(2-pyridinylmethyl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazino)-N-(2-pyridylmethyl)quinoline-3-carboxamide Formula: C23H26FN5O2 MolecularWeight: 423.483243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NCC4=CC=CC=N4

InChI

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