diethyl 2-[[4-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)piperazin-1-yl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)piperazin-1-yl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)piperazine-1-carbonyl]amino]pentanedioate CAS Name: 2-[[[4-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-1-piperazinyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)piperazine-1-carbonyl]amino]pentanedioate Traditional Name: 2-[[4-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)piperazine-1-carbonyl]amino]glutaric acid diethyl ester Formula: C20H31N5O6 MolecularWeight: 437.49004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)N1CCN(CC1)C2=C(NC(=NC2=O)C)C

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)N1CCN(CC1)C2=C(NC(=NC2=O)C)C

InChI

InChI=1S/C20H31N5O6/c1-5-30-16(26)8-7-15(19(28)31-6-2)23-20(29)25-11-9-24(10-12-25)17-13(3)21-14(4)22-18(17)27/h15H,5-12H2,1-4H3,(H,23,29)(H,21,22,27)