1-[[5-(2-methylphenyl)isoquinolin-8-yl]methyl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[[5-(2-methylphenyl)isoquinolin-8-yl]methyl]-3-naphthalen-1-yl-urea Openeye Name: 1-(1-naphthyl)-3-[[5-(o-tolyl)-8-isoquinolyl]methyl]urea CAS Name: 1-[[5-(2-methylphenyl)-8-isoquinolinyl]methyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[[5-(2-methylphenyl)isoquinolin-8-yl]methyl]-3-naphthalen-1-ylurea Traditional Name: 1-(1-naphthyl)-3-[[5-(o-tolyl)-8-isoquinolyl]methyl]urea Formula: C28H23N3O MolecularWeight: 417.50172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C3C=CN=CC3=C(C=C2)CNC(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=CC=C1C2=C3C=CN=CC3=C(C=C2)CNC(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H23N3O/c1-19-7-2-4-10-22(19)24-14-13-21(26-18-29-16-15-25(24)26)17-30-28(32)31-27-12-6-9-20-8-3-5-11-23(20)27/h2-16,18H,17H2,1H3,(H2,30,31,32)