1-(8-bromanylisoquinolin-5-yl)-3-[(4-fluorophenyl)methyl]urea

Systemtic Name: 1-(8-bromanylisoquinolin-5-yl)-3-[(4-fluorophenyl)methyl]urea Openeye Name: 1-(8-bromo-5-isoquinolyl)-3-[(4-fluorophenyl)methyl]urea CAS Name: 1-(8-bromo-5-isoquinolinyl)-3-[(4-fluorophenyl)methyl]urea IUPAC Name: 1-(8-bromoisoquinolin-5-yl)-3-[(4-fluorophenyl)methyl]urea Traditional Name: 1-(8-bromo-5-isoquinolyl)-3-(4-fluorobenzyl)urea Formula: C17H13BrFN3O MolecularWeight: 374.207023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)NC2=C3C=CN=CC3=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)NC2=C3C=CN=CC3=C(C=C2)Br)F

InChI

InChI=1S/C17H13BrFN3O/c18-15-5-6-16(13-7-8-20-10-14(13)15)22-17(23)21-9-11-1-3-12(19)4-2-11/h1-8,10H,9H2,(H2,21,22,23)