Thiamine aldehyde

Molecular Formula: C₁₂H₁₅N₄OS⁺

InChI: InChI=1/C12H15N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15)/q+1/f/h13H2

InChIKey: InChIKey=YLTKXCQXTWMOIT-DLGLGFIGCV
SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CC=O

Names:
    C05856
    Thiamine aldehyde
    2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-5-yl]acetaldehyde

Registries:
    PubChem CID 440815
    PubChem ID 8149