4-[7-chloranyl-2-(methylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[7-chloranyl-2-(methylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[7-chloro-2-(methylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[7-chloro-2-(methylamino)-4-quinolinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-chloro-2-(methylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[7-chloro-2-(methylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C21H21ClFN5O MolecularWeight: 413.875743

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=C(C=CC(=C2)Cl)C(=C1)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CNC1=NC2=C(C=CC(=C2)Cl)C(=C1)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H21ClFN5O/c1-24-20-13-19(17-7-2-14(22)12-18(17)26-20)27-8-10-28(11-9-27)21(29)25-16-5-3-15(23)4-6-16/h2-7,12-13H,8-11H2,1H3,(H,24,26)(H,25,29)