4-Desmethoxy omeprazole sulfide

CAS: 704910-89-4

Ref. 3D-ID63496

Product Information

• Name: 4-Desmethoxy omeprazole sulfide
• Synonyms: 2-[[(3,5-Dimethyl-2-pyridinyl)methyl]thio]-6-methoxy-1H-benzimidazole
• Brand: Biosynth
• Description: 4-Desmethoxy omeprazole sulfide is a metabolite of omeprazole, a drug that is used to treat ulcers and gastroesophageal reflux disease. 4-Desmethoxy omeprazole sulfide is not an impurity in the production of omeprazole, but is present as a natural component of omeprazole. This compound has been shown to be an impurity standard for HPLC analysis. The pharmacopoeia defines 4-desmethoxy omeprazole sulfide as an API impurity in drug products. It is also being studied for its potential use in drug development and research and development.

Chemical properties

• Molecular weight: 299.39 g/mol
• Formula: C₁₆H₁₇N₃OS
• Purity: Min. 95%
• Color/Form: White to off-white solid.
• InChI: InChI=1S/C16H17N3OS/c1-10-6-11(2)15(17-8-10)9-21-16-18-13-5-4-12(20-3)7-14(13)19-16/h4-8H,9H2,1-3H3,(H,18,19)
• InChI key: InChIKey=YTUHHMNQRUNZTP-UHFFFAOYSA-N
• SMILES: COc1ccc2nc(SCc3ncc(C)cc3C)[nH]c2c1