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Substance Name: Carbaspirin calcium, thiamine nitrate drug combination
RN: 76282-90-1
InChIKey: JLCIGFHXYDROAT-UHFFFAOYSA-H

Note

  • Contains calurin (calcium acetylsalicylic carbamidate); Vitamin B1, & aluminum hydroxide.

Molecular Formula

  • C12-H17-N4-O-S.2C9-H8-O4.C-H4-N2-O.Al-H3-O3.Ca.Cl

Molecular Weight

  • 837.2492
 
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Names and Synonyms

Name of Substance

  • Carbaspirin calcium, thiamine nitrate drug combination

Synonyms

  • Alcacyl B1
  • Carbaspirin calcium - thiamine nitrate
  • Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl- chloride, mixt. with aluminum hydroxide, calcium bis(2-(acetyloxy)benzoate) and urea

Systematic Name

  • Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl- chloride, mixt. with aluminum hydroxide (Al(OH)3), calcium bis(2-(acetyloxy)benzoate) and urea

Registry Numbers

CAS Registry Number

  • 76282-90-1

System Generated Number

  • 0076282901

Molecular Formulas

Molecular Formula

  • C12-H17-N4-O-S.2C9-H8-O4.C-H4-N2-O.Al-H3-O3.Ca.Cl

Molecular Formula Fragments

  • Al-H3-O3
  • C-H4-N2-O
  • C12-H17-N4-O-S
  • C9-H8-O4
  • Ca
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C12H17N4OS.2C9H8O4.CH4N2O.Al.Ca.ClH.3H2O/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;2*1-6(10)13-8-5-3-2-4-7(8)9(11)12;2-1(3)4;;;;;;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);2*2-5H,1H3,(H,11,12);(H4,2,3,4);;;1H;3*1H2/q+1;;;;+3;+2;;;;/p-6

InChIKey

JLCIGFHXYDROAT-UHFFFAOYSA-H

Smiles

Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCO.CC(=O)Oc1ccccc1C(=O)[O-].CC(=O)Oc1ccccc1C(=O)[O-].C(=O)(N)N.[OH-].[OH-].[OH-].[Al+3].[Cl-].[Ca+2]