1-[(4-bromanyl-3-fluoranyl-phenyl)methyl]-3-(3-methylisoquinolin-5-yl)urea

Systemtic Name: 1-[(4-bromanyl-3-fluoranyl-phenyl)methyl]-3-(3-methylisoquinolin-5-yl)urea Openeye Name: 1-[(4-bromo-3-fluoro-phenyl)methyl]-3-(3-methyl-5-isoquinolyl)urea CAS Name: 1-[(4-bromo-3-fluorophenyl)methyl]-3-(3-methyl-5-isoquinolinyl)urea IUPAC Name: 1-[(4-bromo-3-fluorophenyl)methyl]-3-(3-methylisoquinolin-5-yl)urea Traditional Name: 1-(4-bromo-3-fluoro-benzyl)-3-(3-methyl-5-isoquinolyl)urea Formula: C18H15BrFN3O MolecularWeight: 388.233603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NCC3=CC(=C(C=C3)Br)F

Isomeric SMILES

CC1=NC=C2C=CC=C(C2=C1)NC(=O)NCC3=CC(=C(C=C3)Br)F

InChI

InChI=1S/C18H15BrFN3O/c1-11-7-14-13(10-21-11)3-2-4-17(14)23-18(24)22-9-12-5-6-15(19)16(20)8-12/h2-8,10H,9H2,1H3,(H2,22,23,24)