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Methimazole-[d3]

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General Information
Catalog: BLP-012441
CAS: 1160932-07-9
Molecular Formula: C4H3D3N2S
Molecular Weight: 117.19

Chemical Structure

Description	Methimazole-[d3] is the labelled analogue of Methimazole. Methimazole is a thiourea antithyroid agent that prevents iodine organification, thus inhibiting the synthesis of thyroxine.
Synonyms	Methimazole D3; 1,3-Dihydro-1-(methyl-d3)-2H-imidazole-2-thione; 1-Methylimidazole-d3-2-thiol
IUPAC Name	3-(trideuteriomethyl)-1H-imidazole-2-thione
Related CAS	60-56-0 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])N1C=CNC1=S
Canonical SMILES	CN1C=CNC1=S
InChI	InChI=1S/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)/i1D3
InChI Key	PMRYVIKBURPHAH-FIBGUPNXSA-N
Boiling Point	280.0±9.0 °C at 760 mmHg
Melting Point	143-146°C
Purity	95% by HPLC; 95% atom D
Density	1.3±0.1 g/cm3
Solubility	Soluble in Chloroform, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C, under inert atmosphere