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2-(4,6-Diamino-1,3,5-triazin-2-yl)sulfanylethanesulfonic Acid-[d4]

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General Information
Catalog: BLP-006378
CAS: 1794737-32-8
Molecular Formula: C5H5D4N5O3S2
Molecular Weight: 255.31

Chemical Structure

Description	2-(4,6-Diamino-1,3,5-triazin-2-yl)sulfanylethanesulfonic Acid-[d4] is the labelled analogue of 2-(4,6-Diamino-1,3,5-triazin-2-yl)sulfanylethanesulfonic acid, which is an impurity of Mesna.
Synonyms	2-(4,6-Diamino-1,3,5-triazin-2-yl)sulfanylethanesulfonic Acid-d4; Mesna EP Impurity E-d4
IUPAC Name	1,1,2,2-tetradeuterio-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]ethanesulfonic acid
Related CAS	1391054-56-0 (unlabelled)
Canonical SMILES	C(CS(=O)(=O)O)SC1=NC(=NC(=N1)N)N
InChI	InChI=1S/C5H9N5O3S2/c6-3-8-4(7)10-5(9-3)14-1-2-15(11,12)13/h1-2H2,(H,11,12,13)(H4,6,7,8,9,10)/i1D2,2D2
InChI Key	VOWJSEYJDXBICY-LNLMKGTHSA-N
Purity	≥98%
Solubility	Soluble in DMSO
Appearance	White Solid
Storage	Store at 2-8°C