Thiamine Thiocarbamate

  • CAT Number: R050235
  • CAS Number: 89285-03-0?
  • Molecular Formula: C14H20N4O3S2
  • Molecular Weight: 356.459
  • Purity: ≥95%
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Catalog Number R050235
CAS Number 89285-03-0?
Synonyms

[(4-Amino-2-methyl-5-pyrimidinyl)methyl]carbamodithioic Acid 1-[2-(Acetyloxy)ethyl]-2-oxopropyl Ester;

Molecular Formula C14H20N4O3S2
Purity ≥95%
Storage Store at -20°C
IUPAC Name [3-[(4-amino-2-methylpyrimidin-5-yl)methylcarbamothioylsulfanyl]-4-oxopentyl] acetate
InChI InChI=1S/C14H20N4O3S2/c1-8(19)12(4-5-21-10(3)20)23-14(22)17-7-11-6-16-9(2)18-13(11)15/h6,12H,4-5,7H2,1-3H3,(H,17,22)(H2,15,16,18)
InChIKey KGQSETSDUBYCAU-UHFFFAOYSA-N
SMILES CC1=NC=C(C(=N1)N)CNC(=S)SC(CCOC(=O)C)C(=O)C

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