1-isoquinolin-5-yl-3-[[2-(trifluoromethyl)phenyl]methyl]urea

Systemtic Name: 1-isoquinolin-5-yl-3-[[2-(trifluoromethyl)phenyl]methyl]urea Openeye Name: 1-(5-isoquinolyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea CAS Name: 1-(5-isoquinolinyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea IUPAC Name: 1-isoquinolin-5-yl-3-[[2-(trifluoromethyl)phenyl]methyl]urea Traditional Name: 1-(5-isoquinolyl)-3-[2-(trifluoromethyl)benzyl]urea Formula: C18H14F3N3O MolecularWeight: 345.31847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)NC2=CC=CC3=C2C=CN=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)NC2=CC=CC3=C2C=CN=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O/c19-18(20,21)15-6-2-1-4-13(15)11-23-17(25)24-16-7-3-5-12-10-22-9-8-14(12)16/h1-10H,11H2,(H2,23,24,25)