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Substance Name: Imidazolethiamine
RN: 305-25-9
UNII: O3ST11RK7W
InChIKey: XDMJYDYAKPEKIU-UHFFFAOYSA-N

Note

  • Analog of thiamine where thiazole ring is replaced by imidazole ring.

Molecular Formula

  • C12-H17-N5-O

Molecular Weight

  • 247.3
 
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Names and Synonyms

Name of Substance

  • Imidazolethiamine

Synonyms

  • Imidazolothiamine
  • UNII-O3ST11RK7W

Systematic Names

  • 1H-Imidazole-4-ethanol, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-methyl-
  • Imidazole-4-ethanol, 1-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-methyl-

Registry Numbers

CAS Registry Number

  • 305-25-9

FDA UNII

  • O3ST11RK7W

Other Registry Numbers

  • 20282-80-8
  • 23539-56-2

System Generated Number

  • 0000305259

Structure Descriptors

InChI

1S/C12H17N5O/c1-8-11(3-4-18)15-7-17(8)6-10-5-14-9(2)16-12(10)13/h5,7,18H,3-4,6H2,1-2H3,(H2,13,14,16)

InChIKey

XDMJYDYAKPEKIU-UHFFFAOYSA-N

Smiles

c1nc(c(n1Cc1c(nc(nc1)C)N)C)CCO