Thiamine bromide

Molecular Formula: C₁₂H₁₇BrN₄OS

InChI: InChI=1/C12H17N4OS.BrH/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);1H/q+1;/p-1/fC12H17N4OS.Br/h13H2;1h/qm;-1

InChIKey: InChIKey=URCYCZPVXXIFSR-IHTMDYTACV
SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[Br-]

Names:
    Thiamine bromide
    Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-, bromide
    2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-5-yl]ethanol bromide
    7019-71-8

Registries:
    PubChem CID 71284
    PubChem ID 213507