1-(4-chlorophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoranyl-phenyl]urea

Systemtic Name: 1-(4-chlorophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoranyl-phenyl]urea Openeye Name: 1-(4-chlorophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoro-phenyl]urea CAS Name: 1-(4-chlorophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluorophenyl]urea IUPAC Name: 1-(4-chlorophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluorophenyl]urea Traditional Name: 1-(4-chlorophenyl)-3-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoro-phenyl]urea Formula: C22H19ClFN3O MolecularWeight: 395.857163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)NC4=CC=C(C=C4)Cl)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)NC4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C22H19ClFN3O/c23-17-5-7-18(8-6-17)25-22(28)26-19-9-10-21(20(24)13-19)27-12-11-15-3-1-2-4-16(15)14-27/h1-10,13H,11-12,14H2,(H2,25,26,28)