Analytenname

Bosentan-13C2, d4

Molekularformel

13C2 C25 D4 H25 N5 O6 S

Molekulargewicht

557.624

Genaue Masse

557.216

SMILES

[2H][13C]([2H])(O)[13C]([2H])([2H])Oc1nc(nc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1Oc3ccccc3OC)c4ncccn4

InChI

InChI=1S/C27H29N5O6S/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/h5-15,33H,16-17H2,1-4H3,(H,30,31,32)/i16+1D2,17+1D2

IUPAC

4-tert-butyl-N-[5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-6-(1,1,2,2-tetradeuterio-2-hydroxy(1,2-13C2)ethoxy)pyrimidin-4-yl]benzenesulfonamide

SIL-Typ

Deuterium, Carbon

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Stable Isotope Labelled

Produktformat

Neat