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N-Methyl Metribuzin-[d3]

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General Information
Catalog: BLP-005052
CAS: 1794754-27-0
Molecular Formula: C9H13D3N4OS
Molecular Weight: 231.33

Chemical Structure

Description	N-Methyl Metribuzin-[d3] is the labelled analogue of N-Methyl Metribuzin, which is an analogue of the herbicide Metribuzin.
Synonyms	N-Methyl Metribuzin D3; SPI-115-d3; 6-(1,1-Dimethylethyl)-4-[(methyl-d3)amino]-3-(methylthio)-1,2,4-triazin-5(4H)-one; 6-tert-Butyl-4-[(methyl-d3)amino]-3-(methylthio)-1,2,4-triazin-5(4H)-one; Metribuzin Methylamine-d3
IUPAC Name	6-tert-butyl-3-methylsulfanyl-4-(trideuteriomethylamino)-1,2,4-triazin-5-one
Related CAS	56742-45-1 (unlabelled)
Canonical SMILES	CC(C)(C)C1=NN=C(N(C1=O)NC)SC
InChI	InChI=1S/C9H16N4OS/c1-9(2,3)6-7(14)13(10-4)8(15-5)12-11-6/h10H,1-5H3/i4D3
InChI Key	JBFWXRSTOLHNFZ-GKOSEXJESA-N
Melting Point	136-137°C
Solubility	Slightly soluble in DMSO, Methanol (Heated, Sonicated)
Appearance	White to Off-white Solid
Storage	Store at 2-8°C