4-chloranyl-2-(4,6-diethoxypyrimidin-2-yl)-5-(3,4-dimethylphenoxy)pyridazin-3-one

Systemtic Name: 4-chloranyl-2-(4,6-diethoxypyrimidin-2-yl)-5-(3,4-dimethylphenoxy)pyridazin-3-one Openeye Name: 4-chloro-2-(4,6-diethoxypyrimidin-2-yl)-5-(3,4-dimethylphenoxy)pyridazin-3-one CAS Name: 4-chloro-2-(4,6-diethoxy-2-pyrimidinyl)-5-(3,4-dimethylphenoxy)-3-pyridazinone IUPAC Name: 4-chloro-2-(4,6-diethoxypyrimidin-2-yl)-5-(3,4-dimethylphenoxy)pyridazin-3-one Traditional Name: 4-chloro-2-(4,6-diethoxypyrimidin-2-yl)-5-(3,4-dimethylphenoxy)pyridazin-3-one Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=NC(=N1)N2C(=O)C(=C(C=N2)OC3=CC(=C(C=C3)C)C)Cl)OCC

Isomeric SMILES

CCOC1=CC(=NC(=N1)N2C(=O)C(=C(C=N2)OC3=CC(=C(C=C3)C)C)Cl)OCC

InChI

InChI=1S/C20H21ClN4O4/c1-5-27-16-10-17(28-6-2)24-20(23-16)25-19(26)18(21)15(11-22-25)29-14-8-7-12(3)13(4)9-14/h7-11H,5-6H2,1-4H3