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Omeprazole Sulfide-[5-methoxy-d3]

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General Information
Catalog: BLP-012919
CAS: 922730-98-1
Molecular Formula: C17H16D3N3O2S
Molecular Weight: 332.44

Chemical Structure

Description	Omeprazole Sulfide-[d3] is the labelled analogue of Omeprazole Sulfide, which is a metabolite of Omeprazole. Omeprazole is a proton pump inhibitor used in the treatment of dyspepsia.
Synonyms	Omeprazole-d3 Sulfide; Omeprazole sulfide-(5-methoxy-d3); 6-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-1H-benzimidazole-d3; 2-[[(3,5-Dimethyl-4-methoxy-2-pyridyl)methyl]thio]-5-methoxybenzimidazole-d3; Pyrmetazole-d3; Ufiprazole-d3
IUPAC Name	2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfanyl]-6-(trideuteriomethoxy)-1H-benzimidazole
Related CAS	73590-85-9 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])OC1=CC2=C(C=C1)N=C(N2)SCC3=NC=C(C(=C3C)OC)C
Canonical SMILES	CC1=CN=C(C(=C1OC)C)CSC2=NC3=C(N2)C=C(C=C3)OC
InChI	InChI=1S/C17H19N3O2S/c1-10-8-18-15(11(2)16(10)22-4)9-23-17-19-13-6-5-12(21-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)/i3D3
InChI Key	XURCIPRUUASYLR-HPRDVNIFSA-N
Melting Point	116-118°C
Purity	≥98% by HPLC; 99% atom D
Solubility	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance	Pale Beige to Beige Solid
Storage	Store at 2-8°C