5-[2-[4-(7-fluoranyl-2-methyl-quinolin-5-yl)piperazin-1-yl]ethyl]-1,6-dimethyl-quinolin-2-one

Systemtic Name: 5-[2-[4-(7-fluoranyl-2-methyl-quinolin-5-yl)piperazin-1-yl]ethyl]-1,6-dimethyl-quinolin-2-one Openeye Name: 5-[2-[4-(7-fluoro-2-methyl-5-quinolyl)piperazin-1-yl]ethyl]-1,6-dimethyl-quinolin-2-one CAS Name: 5-[2-[4-(7-fluoro-2-methyl-5-quinolinyl)-1-piperazinyl]ethyl]-1,6-dimethyl-2-quinolinone IUPAC Name: 5-[2-[4-(7-fluoro-2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-1,6-dimethylquinolin-2-one Traditional Name: 5-[2-[4-(7-fluoro-2-methyl-5-quinolyl)piperazino]ethyl]-1,6-dimethyl-carbostyril Formula: C27H29FN4O MolecularWeight: 444.543763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N(C(=O)C=C2)C)CCN3CCN(CC3)C4=C5C=CC(=NC5=CC(=C4)F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)N(C(=O)C=C2)C)CCN3CCN(CC3)C4=C5C=CC(=NC5=CC(=C4)F)C

InChI

InChI=1S/C27H29FN4O/c1-18-4-8-25-22(7-9-27(33)30(25)3)21(18)10-11-31-12-14-32(15-13-31)26-17-20(28)16-24-23(26)6-5-19(2)29-24/h4-9,16-17H,10-15H2,1-3H3