4-(7-chloranylquinolin-4-yl)-N-(5-fluoranyl-2-methyl-phenyl)piperazine-1-carboxamide

Systemtic Name: 4-(7-chloranylquinolin-4-yl)-N-(5-fluoranyl-2-methyl-phenyl)piperazine-1-carboxamide Openeye Name: 4-(7-chloro-4-quinolyl)-N-(5-fluoro-2-methyl-phenyl)piperazine-1-carboxamide CAS Name: 4-(7-chloro-4-quinolinyl)-N-(5-fluoro-2-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(7-chloroquinolin-4-yl)-N-(5-fluoro-2-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-(7-chloro-4-quinolyl)-N-(5-fluoro-2-methyl-phenyl)piperazine-1-carboxamide Formula: C21H20ClFN4O MolecularWeight: 398.861103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C21H20ClFN4O/c1-14-2-4-16(23)13-18(14)25-21(28)27-10-8-26(9-11-27)20-6-7-24-19-12-15(22)3-5-17(19)20/h2-7,12-13H,8-11H2,1H3,(H,25,28)