3-(6-azanyl-1H-benzimidazol-2-yl)-1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)quinolin-4-one

Systemtic Name: 3-(6-azanyl-1H-benzimidazol-2-yl)-1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)quinolin-4-one Openeye Name: 3-(6-amino-1H-benzimidazol-2-yl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinolin-4-one CAS Name: 3-(6-amino-1H-benzimidazol-2-yl)-1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-quinolinone IUPAC Name: 3-(6-amino-1H-benzimidazol-2-yl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinolin-4-one Traditional Name: 3-(6-amino-1H-benzimidazol-2-yl)-1-ethyl-6-fluoro-7-(4-methylpiperazino)-4-quinolone Formula: C23H25FN6O MolecularWeight: 420.482603

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C4=NC5=C(N4)C=C(C=C5)N

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C4=NC5=C(N4)C=C(C=C5)N

InChI

InChI=1S/C23H25FN6O/c1-3-29-13-16(23-26-18-5-4-14(25)10-19(18)27-23)22(31)15-11-17(24)21(12-20(15)29)30-8-6-28(2)7-9-30/h4-5,10-13H,3,6-9,25H2,1-2H3,(H,26,27)