1-[2,4-bis(fluoranyl)phenyl]-3-(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-3-(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea Openeye Name: 1-(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)-3-(2,4-difluorophenyl)urea CAS Name: 1-(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)-3-(2,4-difluorophenyl)urea IUPAC Name: 1-(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)-3-(2,4-difluorophenyl)urea Traditional Name: 1-(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)-3-(2,4-difluorophenyl)urea Formula: C23H16ClF2N3O2 MolecularWeight: 439.841846

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)NC(=O)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)NC(=O)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C23H16ClF2N3O2/c1-29-21(28-23(31)27-19-10-8-15(25)12-18(19)26)20(13-5-3-2-4-6-13)17-11-14(24)7-9-16(17)22(29)30/h2-12H,1H3,(H2,27,28,31)