8-fluoranyl-4-[[[3-(piperazin-1-ylmethyl)phenyl]-pyrazin-2-yl-amino]methyl]-1H-quinolin-2-one

Systemtic Name: 8-fluoranyl-4-[[[3-(piperazin-1-ylmethyl)phenyl]-pyrazin-2-yl-amino]methyl]-1H-quinolin-2-one Openeye Name: 8-fluoro-4-[[3-(piperazin-1-ylmethyl)-N-pyrazin-2-yl-anilino]methyl]-1H-quinolin-2-one CAS Name: 8-fluoro-4-[[3-(1-piperazinylmethyl)-N-(2-pyrazinyl)anilino]methyl]-1H-quinolin-2-one IUPAC Name: 8-fluoro-4-[[3-(piperazin-1-ylmethyl)-N-pyrazin-2-ylanilino]methyl]-1H-quinolin-2-one Traditional Name: 8-fluoro-4-[[3-(piperazinomethyl)-N-pyrazin-2-yl-anilino]methyl]carbostyril Formula: C25H25FN6O MolecularWeight: 444.504003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC(=CC=C2)N(CC3=CC(=O)NC4=C3C=CC=C4F)C5=NC=CN=C5

Isomeric SMILES

C1CN(CCN1)CC2=CC(=CC=C2)N(CC3=CC(=O)NC4=C3C=CC=C4F)C5=NC=CN=C5

InChI

InChI=1S/C25H25FN6O/c26-22-6-2-5-21-19(14-24(33)30-25(21)22)17-32(23-15-28-7-8-29-23)20-4-1-3-18(13-20)16-31-11-9-27-10-12-31/h1-8,13-15,27H,9-12,16-17H2,(H,30,33)