1-[3-(2-fluoranyl-4-methyl-phenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-3-isoquinolin-5-yl-urea

Systemtic Name: 1-[3-(2-fluoranyl-4-methyl-phenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[3-(2-fluoro-4-methyl-phenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-3-(5-isoquinolyl)urea CAS Name: 1-[3-(2-fluoro-4-methylphenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[3-(2-fluoro-4-methylphenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-3-isoquinolin-5-ylurea Traditional Name: 1-[3-(2-fluoro-4-methyl-phenyl)-3-azabicyclo[3.1.0]hexan-6-yl]-3-(5-isoquinolyl)urea Formula: C22H21FN4O MolecularWeight: 376.426743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CC3C(C2)C3NC(=O)NC4=CC=CC5=C4C=CN=C5)F

Isomeric SMILES

CC1=CC(=C(C=C1)N2CC3C(C2)C3NC(=O)NC4=CC=CC5=C4C=CN=C5)F

InChI

InChI=1S/C22H21FN4O/c1-13-5-6-20(18(23)9-13)27-11-16-17(12-27)21(16)26-22(28)25-19-4-2-3-14-10-24-8-7-15(14)19/h2-10,16-17,21H,11-12H2,1H3,(H2,25,26,28)