Metamizole-d3 (sodium salt)

More details:

• Systematic name

  Sodium {(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)[(~2~H_3_)methyl]amino}methanesulfonate

• SMILES

  CC1=C(C(=O)N(C2=CC=CC=C2)N1C)N(C([2H])([2H])[2H])CS(=O)(=O)[O-].[Na+] [2H]C([2H])([2H])N(CS(=O)(=O)[O-])c1c(n(n(c1=O)c2ccccc2)C)C.[Na+]

• Std. InChi

  InChI=1S/C13H17N3O4S.Na/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;/h4-8H,9H2,1-3H3,(H,18,19,20);/q;+1/p-1/i2D3;

• Std. InChIKey

  DJGAAPFSPWAYTJ-MUTAZJQDSA-M

• Cite this record

  CSID:58780018, http://www.chemspider.com/Chemical-Structure.58780018.html (accessed 08:43, Apr 16, 2024)