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Hydroxy Bosentan-d4

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For Research Use Only | Not For Clinical Use
CATAPS1065472914
CAS1065472-91-4
Structure
IUPAC Name4-(1-hydroxy-2-methylpropan-2-yl)-N-[5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-6-(1,1,2,2-tetradeuterio-2-hydroxyethoxy)pyrimidin-4-yl]benzenesulfonamide
Molecular Weight571.64
Molecular FormulaC272H4H25N5O7S
Canonical SMILES[2H]C([2H])(O)C([2H])([2H])Oc1nc(nc(NS(=O)(=O)c2ccc(cc2)C(C)(C)CO)c1Oc3ccccc3OC)c4ncccn4
InChIInChI=1S/C27H29N5O7S/c1-27(2,17-34)18-9-11-19(12-10-18)40(35,36)32-23-22(39-21-8-5-4-7-20(21)37-3)26(38-16-15-33)31-25(30-23)24-28-13-6-14-29-24/h4-14,33-34H,15-17H2,1-3H3,(H,30,31,32)/i15D2,16D2
Accurate Mass571.2039
FormatNeat
SubcategoryEnzyme inhibitors, Stable isotope labelled compounds
TypeImpurity; Stable Isotope Labelled
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