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Product Code
TRC-B675905
CAS Number
Product Format
Neat
Molecular Formula
C27 H29 N5 O6 S . H2 O
Molecular Weight
569.63
Product Categories
Product Type
APIAlternate CAS Number
Purity
>95% (HPLC)
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Analyte Name
Bosentan Monohydrate
CAS Number
157212-55-0
Molecular Formula
C27 H29 N5 O6 S . H2 O
Molecular Weight
569.63
Accurate Mass
569.1944
SMILES
O.COc1ccccc1Oc2c(NS(=O)(=O)c3ccc(cc3)C(C)(C)C)nc(nc2OCCO)c4ncccn4
InChI
InChI=1S/C27H29N5O6S.H2O/c1-27(2,3)18-10-12-19(13-11-18)39(34,35)32-23-22(38-21-9-6-5-8-20(21)36-4)26(37-17-16-33)31-25(30-23)24-28-14-7-15-29-24, 1H2, /h5-15,33H,16-17H2,1-4H3,(H,30,31,32)
IUPAC
4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide;hydrate
Alternate CAS Number
Free base: 147536-97-8
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
API Family
Purity
>95% (HPLC)
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