(4S)-7-fluoranyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxamide

Systemtic Name: (4S)-7-fluoranyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxamide Openeye Name: (4S)-7-fluoro-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide CAS Name: (4S)-7-fluoro-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide IUPAC Name: (4S)-7-fluoro-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide Traditional Name: (4S)-7-fluoro-2-keto-N-[2-methyl-4-(4-methylpiperazino)phenyl]-3,4-dihydro-1H-quinoline-4-carboxamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3CC(=O)NC4=C3C=CC(=C4)F

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)[C@H]3CC(=O)NC4=C3C=CC(=C4)F

InChI

InChI=1S/C22H25FN4O2/c1-14-11-16(27-9-7-26(2)8-10-27)4-6-19(14)25-22(29)18-13-21(28)24-20-12-15(23)3-5-17(18)20/h3-6,11-12,18H,7-10,13H2,1-2H3,(H,24,28)(H,25,29)/t18-/m0/s1