2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-5-morpholin-4-yl-pyridazin-3-one

Systemtic Name: 2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-5-morpholin-4-yl-pyridazin-3-one Openeye Name: 2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-5-morpholino-pyridazin-3-one CAS Name: 2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-5-(4-morpholinyl)-3-pyridazinone IUPAC Name: 2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-5-morpholin-4-ylpyridazin-3-one Traditional Name: 2-[(3,3-dimethyl-4H-isoquinolin-1-yl)methyl]-5-morpholino-pyridazin-3-one Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=N1)CN3C(=O)C=C(C=N3)N4CCOCC4)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=N1)CN3C(=O)C=C(C=N3)N4CCOCC4)C

InChI

InChI=1S/C20H24N4O2/c1-20(2)12-15-5-3-4-6-17(15)18(22-20)14-24-19(25)11-16(13-21-24)23-7-9-26-10-8-23/h3-6,11,13H,7-10,12,14H2,1-2H3