Molecular properties
- Formula
- C12H17N4OS
- Molar mass
- 265.36 g·mol−1
- Exact mass
- 265.1117 Da
- Formal charge
- +
- 6.5
- PubChem CID
- 1130
Molecule record
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol
C12H17N4OS
265.36 g/mol
Charge +
Loading structure
Functional groups
Alcohol
Alkane / alkyl carbon
Aromatic ring
Primary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM
- 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium
- Aneurin
- Antiberiberi factor
- B-Amin
- Betabion
- Betaxin
- Bewon
Show all 24 synonyms
- CHEBI:33283
- Lixa-beta
- Oryzanine
- Thiaminal
- Thiamine, chloride
- Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-chloride
- Trophite
- Vetalin S
- Vinothiam
- Vitamin B 1
- thiamin
- thiamine
- thiamine(1+) ion
- thiaminium
- vitamin B1
- vitaminum b1
Structure identifiers
- Canonical SMILES
- Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1
- Isomeric SMILES
- CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO
- InChI
- InChI=1S/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1
- InChIKey
- JZRWCGZRTZMZEH-UHFFFAOYSA-N
- PubChem CID
- 1130
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.