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Substance Name: MB 3
RN: 42207-96-5
InChIKey: ZJZCTCNQTXBBFZ-PLMZOXRSSA-N

Note

  • Inhibits amidopyrine-N-demethylation.

Molecular Weight

  • 465.015
 
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Names and Synonyms

Name of Substance

  • MB 3

Synonyms

  • MB-3
  • S-(beta-p-Methylpropiophenone)thiamine

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 42207-96-5

System Generated Number

  • 0042207965

Structure Descriptors

InChI

1S/C22H28N4O3S.ClH/c1-15-4-6-18(7-5-15)20(29)9-11-30-21(8-10-27)16(2)26(14-28)13-19-12-24-17(3)25-22(19)23;/h4-7,12,14,27H,8-11,13H2,1-3H3,(H2,23,24,25);1H/b21-16-;

InChIKey

ZJZCTCNQTXBBFZ-PLMZOXRSSA-N

Smiles

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