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

Systemtic Name: 4-[7-chloranyl-2-(cyclopropylmethylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[7-chloro-2-(cyclopropylmethylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[7-chloro-2-(cyclopropylmethylamino)-4-quinolinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-chloro-2-(cyclopropylmethylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[7-chloro-2-(cyclopropylmethylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C24H25ClFN5O MolecularWeight: 453.939603

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC3=C(C=CC(=C3)Cl)C(=C2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)F

Isomeric SMILES

C1CC1CNC2=NC3=C(C=CC(=C3)Cl)C(=C2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)F

InChI

InChI=1S/C24H25ClFN5O/c25-17-3-8-20-21(13-17)29-23(27-15-16-1-2-16)14-22(20)30-9-11-31(12-10-30)24(32)28-19-6-4-18(26)5-7-19/h3-8,13-14,16H,1-2,9-12,15H2,(H,27,29)(H,28,32)