1-[3-[[5-(3-hydroxyphenyl)isoquinolin-1-yl]amino]phenyl]urea

Systemtic Name: 1-[3-[[5-(3-hydroxyphenyl)isoquinolin-1-yl]amino]phenyl]urea Openeye Name: [3-[[5-(3-hydroxyphenyl)-1-isoquinolyl]amino]phenyl]urea CAS Name: [3-[[5-(3-hydroxyphenyl)-1-isoquinolinyl]amino]phenyl]urea IUPAC Name: [3-[[5-(3-hydroxyphenyl)isoquinolin-1-yl]amino]phenyl]urea Traditional Name: [3-[[5-(3-hydroxyphenyl)-1-isoquinolyl]amino]phenyl]urea Formula: C22H18N4O2 MolecularWeight: 370.40392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C2=CC=CC3=C2C=CN=C3NC4=CC(=CC=C4)NC(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)O)C2=CC=CC3=C2C=CN=C3NC4=CC(=CC=C4)NC(=O)N

InChI

InChI=1S/C22H18N4O2/c23-22(28)26-16-6-2-5-15(13-16)25-21-20-9-3-8-18(19(20)10-11-24-21)14-4-1-7-17(27)12-14/h1-13,27H,(H,24,25)(H3,23,26,28)