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

Systemtic Name: 4-[7-chloranyl-2-(cyclopropylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[7-chloro-2-(cyclopropylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[7-chloro-2-(cyclopropylamino)-4-quinolinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-chloro-2-(cyclopropylamino)quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[7-chloro-2-(cyclopropylamino)-4-quinolyl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C23H23ClFN5O MolecularWeight: 439.913023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC3=C(C=CC(=C3)Cl)C(=C2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)F

Isomeric SMILES

C1CC1NC2=NC3=C(C=CC(=C3)Cl)C(=C2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)F

InChI

InChI=1S/C23H23ClFN5O/c24-15-1-8-19-20(13-15)28-22(26-17-6-7-17)14-21(19)29-9-11-30(12-10-29)23(31)27-18-4-2-16(25)3-5-18/h1-5,8,13-14,17H,6-7,9-12H2,(H,26,28)(H,27,31)