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

Systemtic Name: 4-[2-(aminocarbonylamino)-7-chloranyl-quinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-(7-chloro-2-ureido-4-quinolyl)-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[2-(carbamoylamino)-7-chloro-4-quinolinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[2-(carbamoylamino)-7-chloroquinolin-4-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-(7-chloro-2-ureido-4-quinolyl)-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C21H20ClFN6O2 MolecularWeight: 442.873903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)NC(=O)N)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)NC(=O)N)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H20ClFN6O2/c22-13-1-6-16-17(11-13)26-19(27-20(24)30)12-18(16)28-7-9-29(10-8-28)21(31)25-15-4-2-14(23)3-5-15/h1-6,11-12H,7-10H2,(H,25,31)(H3,24,26,27,30)