1-isoquinolin-5-yl-3-[(4-pyridin-2-ylphenyl)methyl]urea

Systemtic Name: 1-isoquinolin-5-yl-3-[(4-pyridin-2-ylphenyl)methyl]urea Openeye Name: 1-(5-isoquinolyl)-3-[[4-(2-pyridyl)phenyl]methyl]urea CAS Name: 1-(5-isoquinolinyl)-3-[[4-(2-pyridinyl)phenyl]methyl]urea IUPAC Name: 1-isoquinolin-5-yl-3-[(4-pyridin-2-ylphenyl)methyl]urea Traditional Name: 1-(5-isoquinolyl)-3-[4-(2-pyridyl)benzyl]urea Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(C=C2)CNC(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(C=C2)CNC(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H18N4O/c27-22(26-21-6-3-4-18-15-23-13-11-19(18)21)25-14-16-7-9-17(10-8-16)20-5-1-2-12-24-20/h1-13,15H,14H2,(H2,25,26,27)