3-(1H-benzimidazol-2-yl)-7-(cyclopropylamino)-6-fluoranyl-1-(octan-3-ylamino)quinolin-2-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-7-(cyclopropylamino)-6-fluoranyl-1-(octan-3-ylamino)quinolin-2-one Openeye Name: 3-(1H-benzimidazol-2-yl)-7-(cyclopropylamino)-1-(1-ethylhexylamino)-6-fluoro-quinolin-2-one CAS Name: 3-(1H-benzimidazol-2-yl)-7-(cyclopropylamino)-6-fluoro-1-(octan-3-ylamino)-2-quinolinone IUPAC Name: 3-(1H-benzimidazol-2-yl)-7-(cyclopropylamino)-6-fluoro-1-(octan-3-ylamino)quinolin-2-one Traditional Name: 3-(1H-benzimidazol-2-yl)-7-(cyclopropylamino)-1-(1-ethylhexylamino)-6-fluoro-carbostyril Formula: C27H32FN5O MolecularWeight: 461.574283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NN1C2=CC(=C(C=C2C=C(C1=O)C3=NC4=CC=CC=C4N3)F)NC5CC5

Isomeric SMILES

CCCCCC(CC)NN1C2=CC(=C(C=C2C=C(C1=O)C3=NC4=CC=CC=C4N3)F)NC5CC5

InChI

InChI=1S/C27H32FN5O/c1-3-5-6-9-18(4-2)32-33-25-16-24(29-19-12-13-19)21(28)15-17(25)14-20(27(33)34)26-30-22-10-7-8-11-23(22)31-26/h7-8,10-11,14-16,18-19,29,32H,3-6,9,12-13H2,1-2H3,(H,30,31)