Biotamin

Molecular Formula: C₁₉H₂₃N₄O₆PS

InChI: InChI=1/C19H23N4O6PS/c1-13(23(12-24)11-16-10-21-14(2)22-18(16)20)17(8-9-29-30(26,27)28)31-19(25)15-6-4-3-5-7-15/h3-7,10,12H,8-9,11H2,1-2H3,(H2,20,21,22)(H2,26,27,28)/b17-13+/f/h26-27H,20H2

InChIKey: InChIKey=BTNNPSLJPBRMLZ-PWDHQXFZDA
SMILES: CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOP(=O)(O)O)SC(=O)C2=CC=CC=C2)C

Names:
    Benfotiamine (JAN)
    benfotiamine
    Biotamin (TN)
    Biotamin
    D01255
    22457-89-2
    [(E)-4-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-3-benzoylsulfanyl-pent-3-enoxy]phosphonic acid

Registries:
    PubChem CID 5282168
    PubChem ID 7848318