2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl sulfate

Modify Date: 2025-09-02 07:16:29

2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl sulfate Structure
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl sulfate structure
Common Name 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl sulfate
CAS Number 2380-61-2 Molecular Weight 344.41000
Density N/A Boiling Point N/A
Molecular Formula C12H16N4O4S2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl sulfate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C12H16N4O4S2
Molecular Weight 344.41000
Exact Mass 344.06100
PSA 159.46000
LogP 1.10310
InChIKey DXANYXRZRNXGSC-UHFFFAOYSA-N
SMILES Cc1ncc(C[n+]2csc(CCOS(=O)(=O)[O-])c2C)c(N)n1

 Synonyms

3-(4-amino-2-methyl-pyrimidin-5-ylmethyl)-4-methyl-5-(2-sulfooxy-ethyl)-thiazolium betaine
Thiamine Hydrogen Sulfate Ester Inner Salt
3-(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-4-methyl-5-(2-sulfooxy-aethyl)-thiazolium-betain
3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-[2-(sulfooxy)ethyl]thiazolium Inner Salt
Thiamine Sulfate
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