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Substance Name: S-(beta-p-methoxypropiophenone)thiamine
RN: 42207-95-4
InChIKey: SBMHSEJILCTAHF-XGRJIHFXSA-N

Note

  • Inhibits amidopyrine-N-demethylation.

Molecular Weight

  • 481.014
 
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Names and Synonyms

Name of Substance

  • S-(beta-p-methoxypropiophenone)thiamine

Synonyms

  • MB 2
  • MB-2
  • S-(beta-p-Methoxypropiophenone)thiamine

Systematic Name

  • N-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-N-(4-hydroxy-2-((3-(4-methoxyphenyl)-3-oxopropyl)thio)-1-methyl-1-butenyl)formamide, monohydrochloride

Registry Numbers

CAS Registry Number

  • 42207-95-4

System Generated Number

  • 0042207954

Structure Descriptors

InChI

1S/C22H28N4O4S.ClH/c1-15(26(14-28)13-18-12-24-16(2)25-22(18)23)21(8-10-27)31-11-9-20(29)17-4-6-19(30-3)7-5-17;/h4-7,12,14,27H,8-11,13H2,1-3H3,(H2,23,24,25);1H/b21-15-;

InChIKey

SBMHSEJILCTAHF-XGRJIHFXSA-N

Smiles

C(=O)N(C(=C(/CCO)SCCC(=O)c1ccc(cc1)OC)\C)Cc1c(nc(nc1)C)N.Cl