1-[[5-(4-methoxy-3-methyl-phenyl)isoquinolin-8-yl]methyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[[5-(4-methoxy-3-methyl-phenyl)isoquinolin-8-yl]methyl]-3-(3-methylphenyl)urea Openeye Name: 1-[[5-(4-methoxy-3-methyl-phenyl)-8-isoquinolyl]methyl]-3-(m-tolyl)urea CAS Name: 1-[[5-(4-methoxy-3-methylphenyl)-8-isoquinolinyl]methyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[[5-(4-methoxy-3-methylphenyl)isoquinolin-8-yl]methyl]-3-(3-methylphenyl)urea Traditional Name: 1-[[5-(4-methoxy-3-methyl-phenyl)-8-isoquinolyl]methyl]-3-(m-tolyl)urea Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC(=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC(=C(C=C4)OC)C

InChI

InChI=1S/C26H25N3O2/c1-17-5-4-6-21(13-17)29-26(30)28-15-20-7-9-22(23-11-12-27-16-24(20)23)19-8-10-25(31-3)18(2)14-19/h4-14,16H,15H2,1-3H3,(H2,28,29,30)