diethyl 2-[[[2-(dimethylamino)quinazolin-4-yl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[2-(dimethylamino)quinazolin-4-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[2-(dimethylamino)quinazolin-4-yl]amino]methylene]propanedioate CAS Name: 2-[[[2-(dimethylamino)-4-quinazolinyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[[2-(dimethylamino)quinazolin-4-yl]amino]methylidene]propanedioate Traditional Name: 2-[[[2-(dimethylamino)quinazolin-4-yl]amino]methylene]malonic acid diethyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC(=NC2=CC=CC=C21)N(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NC(=NC2=CC=CC=C21)N(C)C)C(=O)OCC

InChI

InChI=1S/C18H22N4O4/c1-5-25-16(23)13(17(24)26-6-2)11-19-15-12-9-7-8-10-14(12)20-18(21-15)22(3)4/h7-11H,5-6H2,1-4H3,(H,19,20,21)