2-[6-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoylamino]pentanedioic acid

Systemtic Name: 2-[6-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoylamino]pentanedioic acid Openeye Name: 2-[6-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)hexanoylamino]pentanedioic acid CAS Name: 2-[[6-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-1-oxohexyl]amino]pentanedioic acid IUPAC Name: 2-[6-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)hexanoylamino]pentanedioic acid Traditional Name: 2-[6-(2,6-diamino-4-keto-1H-pyrimidin-5-yl)hexanoylamino]glutaric acid Formula: C15H23N5O6 MolecularWeight: 369.37302

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC1=C(NC(=NC1=O)N)N)CCC(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C(CCC1=C(NC(=NC1=O)N)N)CCC(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C15H23N5O6/c16-12-8(13(24)20-15(17)19-12)4-2-1-3-5-10(21)18-9(14(25)26)6-7-11(22)23/h9H,1-7H2,(H,18,21)(H,22,23)(H,25,26)(H5,16,17,19,20,24)