N-[(4-fluoranyl-2-methyl-phenyl)methyl]-N'-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)butanediamide

Systemtic Name: N-[(4-fluoranyl-2-methyl-phenyl)methyl]-N'-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)butanediamide Openeye Name: N-[(4-fluoro-2-methyl-phenyl)methyl]-N'-[4-methyl-2-(1-piperidyl)-6-quinolyl]butanediamide CAS Name: N-[(4-fluoro-2-methylphenyl)methyl]-N'-[4-methyl-2-(1-piperidinyl)-6-quinolinyl]butanediamide IUPAC Name: N-[(4-fluoro-2-methylphenyl)methyl]-N'-(4-methyl-2-piperidin-1-ylquinolin-6-yl)butanediamide Traditional Name: N-(4-fluoro-2-methyl-benzyl)-N'-(4-methyl-2-piperidino-6-quinolyl)succinamide Formula: C27H31FN4O2 MolecularWeight: 462.559043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)NCC3=C(C=C(C=C3)F)C)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)NCC3=C(C=C(C=C3)F)C)N4CCCCC4

InChI

InChI=1S/C27H31FN4O2/c1-18-14-21(28)7-6-20(18)17-29-26(33)10-11-27(34)30-22-8-9-24-23(16-22)19(2)15-25(31-24)32-12-4-3-5-13-32/h6-9,14-16H,3-5,10-13,17H2,1-2H3,(H,29,33)(H,30,34)