Pantoprazole Sulfone - CAS 127780-16-9

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Catalog Number: R047658

CAS Number: 127780-16-9

PubChem Substance ID:355193578

Molecular Formula: C16H15F2N3O5S

Molecular Weight:399.369

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

• Synonyms: 5-Difluoromethoxy-2-[[(3,4-dimethoxy)-2-pyridyl]methylsulfonyl]-1H-benzimidazole; USP Pantoprazole Related Compound A

Property

• Molecular Formula: C16H15F2N3O5S
• Molecular Weight: 399.369
• Purity: ≥95%
• Storage: -20°C

Computed Descriptor

• IUPAC Name: 6-(difluoromethoxy)-2-[(3,4-dimethoxypyridin-2-yl)methylsulfonyl]-1H-benzimidazole
• InChI: InChI=1S/C16H15F2N3O5S/c1-24-13-5-6-19-12(14(13)25-2)8-27(22,23)16-20-10-4-3-9(26-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)
• InChIKey: FCJYMBZQIJDMMM-UHFFFAOYSA-N
• SMILES: COC1=C(C(=NC=C1)CS(=O)(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC