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Product Overview

Product Code

TRC-D290485

CAS Number

174227-14-6

USP Description

Bosentan USP Related Compound B

Product Format

Neat

Molecular Formula

C25 H25 N5 O5 S

Molecular Weight

507.56

API Family

Bosentan

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

O-Deshydroxyethyl Bosentan

CAS Number

174227-14-6

Molecular Formula

C25 H25 N5 O5 S

Molecular Weight

507.56

Accurate Mass

507.1576

SMILES

COc1ccccc1Oc2c(O)nc(nc2NS(=O)(=O)c3ccc(cc3)C(C)(C)C)c4ncccn4

InChI

InChI=1S/C25H25N5O5S/c1-25(2,3)16-10-12-17(13-11-16)36(32,33)30-21-20(35-19-9-6-5-8-18(19)34-4)24(31)29-23(28-21)22-26-14-7-15-27-22/h5-15H,1-4H3,(H2,28,29,30,31)

IUPAC

4-tert-butyl-N-[6-hydroxy-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Bosentan

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