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Details

Stereochemistry ACHIRAL
Molecular Formula C27H28N5O6S.Na
Molecular Weight 573.596
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BOSENTAN SODIUM

SMILES

[Na+].COC1=CC=CC=C1OC2=C(OCCO)N=C(N=C2[N-]S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=NC=CC=N4

InChI

InChIKey=RFZVORNKUWIYLO-UHFFFAOYSA-N
InChI=1S/C27H28N5O6S.Na/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;/q-1;+1

HIDE SMILES / InChI

Molecular Formula C27H28N5O6S
Molecular Weight 550.606
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:45:41 UTC 2023
Edited
by admin
on Sat Dec 16 10:45:41 UTC 2023
Record UNII
R0I9YS355L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BOSENTAN SODIUM
Common Name English
4-(1,1-DIMETHYLETHYL)-N-(6-(2-HYDROXYETHOXY)-5-(2-METHOXYPHENOXY)(2,2'-BIPYRIMIDIN)-4-YL)BENZENESULFONAMIDE SODIUM SALT
Systematic Name English
BOSENTAN SODIUM ANHYDROUS
Common Name English
BOSENTAN ANHYDROUS SODIUM
Common Name English
BOSENTAN SODIUM SALT [MI]
Common Name English
BENZENESULFONAMIDE, 4-(1,1-DIMETHYLETHYL)-N-(6-(2-HYDROXYETHOXY)-5-(2-METHOXYPHENOXY)(2,2'-BIPYRIMIDIN)-4-YL)-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
R0I9YS355L
Created by admin on Sat Dec 16 10:45:41 UTC 2023 , Edited by admin on Sat Dec 16 10:45:41 UTC 2023
PRIMARY
PUBCHEM
44387533
Created by admin on Sat Dec 16 10:45:41 UTC 2023 , Edited by admin on Sat Dec 16 10:45:41 UTC 2023
PRIMARY
EPA CompTox
DTXSID40678686
Created by admin on Sat Dec 16 10:45:41 UTC 2023 , Edited by admin on Sat Dec 16 10:45:41 UTC 2023
PRIMARY
CAS
150726-52-6
Created by admin on Sat Dec 16 10:45:41 UTC 2023 , Edited by admin on Sat Dec 16 10:45:41 UTC 2023
PRIMARY
MERCK INDEX
m2625
Created by admin on Sat Dec 16 10:45:41 UTC 2023 , Edited by admin on Sat Dec 16 10:45:41 UTC 2023
PRIMARY Merck Index