(2-((2-(2-Aminoethyl)amino)methyl)-5-bromo-N-(2-(1H-imidazol-4-yl)ethyl)-4-pyrimidinecarboxamidato)aquacobalt dinitrate
[CAS# 122019-28-7]

Identification

• Name: (2-((2-(2-Aminoethyl)amino)methyl)-5-bromo-N-(2-(1H-imidazol-4-yl)ethyl)-4-pyrimidinecarboxamidato)aquacobalt dinitrate
• Synonyms: Cobaltic [2-[(2-Aminoethylamino)Methyl]-5-Bromo-Pyrimidine-4-Carbonyl]-[2-(3H-Imidazol-4-Yl)Ethyl]Azanide Dinitrate Hydrate; Cobaltic [[2-[(2-Aminoethylamino)Methyl]-5-Bromo-4-Pyrimidinyl]-Oxomethyl]-[2-(3H-Imidazol-4-Yl)Ethyl]Azanide Dinitrate Hydrate; [2-[(2-Aminoethylamino)Methyl]-5-Bromo-Pyrimidin-4-Yl]Carbonyl-[2-(3H-Imidazol-4-Yl)Ethyl]Azanide; Cobalt(+3) Cation; Dinitrate; Hydrate
• Molecular Formula: C₁₃H₁₉BrCoN₉O₈
• Molecular Weight: 568.19
• CAS Registry Number: 122019-28-7
• SMILES: [Co+3].[N+]([O-])([O-])=O.C1=NC(=NC(=C1Br)C([O-])=NCCC2=CN=C[NH]2)CNCCN.O=[N+]([O-])[O-].O
• InChI: 1S/C13H18BrN7O.Co.2NO3.H2O/c14-10-6-19-11(7-16-4-2-15)21-12(10)13(22)18-3-1-9-5-17-8-20-9;;2*2-1(3)4;/h5-6,8,16H,1-4,7,15H2,(H,17,20)(H,18,22);;;;1H2/q;+3;2*-1;/p-1
• InChIKey: VDCXWODFOFLSMZ-UHFFFAOYSA-M