3-[2,4-bis(fluoranyl)phenyl]-1-butyl-1-(6-chloranyl-4-phenyl-quinolin-2-yl)urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-butyl-1-(6-chloranyl-4-phenyl-quinolin-2-yl)urea Openeye Name: 1-butyl-1-(6-chloro-4-phenyl-2-quinolyl)-3-(2,4-difluorophenyl)urea CAS Name: 1-butyl-1-(6-chloro-4-phenyl-2-quinolinyl)-3-(2,4-difluorophenyl)urea IUPAC Name: 1-butyl-1-(6-chloro-4-phenylquinolin-2-yl)-3-(2,4-difluorophenyl)urea Traditional Name: 1-butyl-1-(6-chloro-4-phenyl-2-quinolyl)-3-(2,4-difluorophenyl)urea Formula: C26H22ClF2N3O MolecularWeight: 465.922186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC2=C(C=C(C=C2)Cl)C(=C1)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

CCCCN(C1=NC2=C(C=C(C=C2)Cl)C(=C1)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C26H22ClF2N3O/c1-2-3-13-32(26(33)31-24-12-10-19(28)15-22(24)29)25-16-20(17-7-5-4-6-8-17)21-14-18(27)9-11-23(21)30-25/h4-12,14-16H,2-3,13H2,1H3,(H,31,33)