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

Systemtic Name: 1-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-3-(3-fluorophenyl)urea Openeye Name: 1-[[5-(4-ethoxyphenyl)-8-isoquinolyl]methyl]-3-(3-fluorophenyl)urea CAS Name: 1-[[5-(4-ethoxyphenyl)-8-isoquinolinyl]methyl]-3-(3-fluorophenyl)urea IUPAC Name: 1-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-3-(3-fluorophenyl)urea Traditional Name: 1-(3-fluorophenyl)-3-[(5-p-phenetyl-8-isoquinolyl)methyl]urea Formula: C25H22FN3O2 MolecularWeight: 415.459483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C25H22FN3O2/c1-2-31-21-9-6-17(7-10-21)22-11-8-18(24-16-27-13-12-23(22)24)15-28-25(30)29-20-5-3-4-19(26)14-20/h3-14,16H,2,15H2,1H3,(H2,28,29,30)