Chemical Compound

Bosentan hydrate

CAS Registry Number 157212-55-0
Bosentan hydrate chemical structure
Primary Record

Bosentan hydrate

In stock
8,741 g
Purity
98.2 %
CAS
157212-55-0

Compound Identifiers & Properties

CAS
157212-55-0
PubChem CID
123134643
SMILES
[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC
Canonical SMILES
COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCO.[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH].[HH]

Names & Synonyms

  • Bosentan hydrate
  • 157212-55-0