diethyl 2-[[4-[4-(6-azanyl-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)butyl]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-[4-(6-azanyl-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)butyl]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-[4-(6-amino-2-methyl-4-oxo-1H-pyrimidin-5-yl)butyl]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[4-(6-amino-2-methyl-4-oxo-1H-pyrimidin-5-yl)butyl]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[4-(6-amino-2-methyl-4-oxo-1H-pyrimidin-5-yl)butyl]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[4-(6-amino-4-keto-2-methyl-1H-pyrimidin-5-yl)butyl]benzoyl]amino]glutaric acid diethyl ester Formula: C25H34N4O6 MolecularWeight: 486.56066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)CCCCC2=C(NC(=NC2=O)C)N

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)CCCCC2=C(NC(=NC2=O)C)N

InChI

InChI=1S/C25H34N4O6/c1-4-34-21(30)15-14-20(25(33)35-5-2)29-23(31)18-12-10-17(11-13-18)8-6-7-9-19-22(26)27-16(3)28-24(19)32/h10-13,20H,4-9,14-15H2,1-3H3,(H,29,31)(H3,26,27,28,32)