1-(8-cyanospiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)-3-isoquinolin-5-yl-urea

Systemtic Name: 1-(8-cyanospiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)-3-isoquinolin-5-yl-urea Openeye Name: 1-(8-cyanospiro[chromane-2,1'-cyclobutane]-4-yl)-3-(5-isoquinolyl)urea CAS Name: 1-(8-cyano-4-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclobutane]yl)-3-(5-isoquinolinyl)urea IUPAC Name: 1-(8-cyanospiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)-3-isoquinolin-5-ylurea Traditional Name: 1-(8-cyanospiro[chroman-2,1'-cyclobutane]-4-yl)-3-(5-isoquinolyl)urea Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1)CC(C3=CC=CC(=C3O2)C#N)NC(=O)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CC2(C1)CC(C3=CC=CC(=C3O2)C#N)NC(=O)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C23H20N4O2/c24-13-15-4-1-6-18-20(12-23(9-3-10-23)29-21(15)18)27-22(28)26-19-7-2-5-16-14-25-11-8-17(16)19/h1-2,4-8,11,14,20H,3,9-10,12H2,(H2,26,27,28)