diethyl 2-[7-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)quinazolin-4-yl]propanedioate

Systemtic Name: diethyl 2-[7-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)quinazolin-4-yl]propanedioate Openeye Name: diethyl 2-[7-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)quinazolin-4-yl]propanedioate CAS Name: 2-[7-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-4-quinazolinyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[7-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)quinazolin-4-yl]propanedioate Traditional Name: 2-[7-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)quinazolin-4-yl]malonic acid diethyl ester Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NC=NC2=C1C=CC(=C2)C3=NNC(=O)CC3C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=NC=NC2=C1C=CC(=C2)C3=NNC(=O)CC3C)C(=O)OCC

InChI

InChI=1S/C20H22N4O5/c1-4-28-19(26)16(20(27)29-5-2)18-13-7-6-12(9-14(13)21-10-22-18)17-11(3)8-15(25)23-24-17/h6-7,9-11,16H,4-5,8H2,1-3H3,(H,23,25)