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Tizanidine-[d4] Hydrochloride

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General Information
Catalog: BLP-012625
CAS: 1188263-51-5
Molecular Formula: C9H5D4Cl2N5S
Molecular Weight: 294.20

Chemical Structure

Description	Tizanidine-[d4] Hydrochloride is the labelled analogue of Tizanidine, which has been found to be an α2-adrenergic agonist and could be used as a muscle as well as skeletal relaxant.
Synonyms	Tizanidine-d4 Hydrochloride; 5-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl-d4)-2,1,3-benzothiadiazol-4-amine Hydrochloride
IUPAC Name	5-chloro-N-(4,4,5,5-tetradeuterio-1H-imidazol-2-yl)-2,1,3-benzothiadiazol-4-amine;hydrochloride
Related CAS	64461-82-1 (unlabelled) 1188331-19-2 (free base)
Isomeric SMILES	[2H]C1(C(N=C(N1)NC2=C(C=CC3=NSN=C32)Cl)([2H])[2H])[2H].Cl
Canonical SMILES	C1CN=C(N1)NC2=C(C=CC3=NSN=C32)Cl.Cl
InChI	InChI=1S/C9H8ClN5S.ClH/c10-5-1-2-6-8(15-16-14-6)7(5)13-9-11-3-4-12-9;/h1-2H,3-4H2,(H2,11,12,13);1H/i3D2,4D2;
InChI Key	ZWUKMNZJRDGCTQ-URZLSVTISA-N
Melting Point	275-279°C (dec.)
Purity	95% by HPLC; 95% atom D
Solubility	Soluble in Methanol, Water
Appearance	White to Pale Yellow Solid
Storage	Store at -20°C