O-DESHYDROXYETHYL BOSENTAN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H25N5O5S
Molecular Weight	507.562
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(OC2=C(NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)NC(=NC2=O)C4=NC=CC=N4)C=CC=C1

InChI

InChIKey=REEANFGHAAWSIZ-UHFFFAOYSA-N

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)

HIDE SMILES / InChI

Molecular Formula	C25H25N5O5S
Molecular Weight	507.562
Charge	0
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 `Mon Mar 31 23:35:17 GMT 2025` Edited by `admin` on `Mon Mar 31 23:35:17 GMT 2025`
Record UNII	9B7A5GJ8V8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-TERT-BUTYL-N-(6-HYDROXY-5-(2-METHOXYPHENOXY)-2,2'-BIPYRIMIDIN-4-YL)BENZENESULFONAMIDE

Preferred Name

English

O-DESHYDROXYETHYL BOSENTAN

Common Name

English

BENZENESULFONAMIDE, N-(1,6-DIHYDRO-5-(2-METHOXYPHENOXY)-6-OXO(2,2'-BIPYRIMIDIN)-4-YL)-4-(1,1-DIMETHYLETHYL)-

Systematic Name

English

N-(1,6-DIHYDRO-5-(2-METHOXYPHENOXY)-6-OXO(2,2'-BIPYRIMIDIN)-4-YL)-4-(1,1-DIMETHYLETHYL)BENZENESULFONAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

136345352

Created by admin on Mon Mar 31 23:35:17 GMT 2025 , Edited by admin on Mon Mar 31 23:35:17 GMT 2025

PRIMARY

FDA UNII

9B7A5GJ8V8

Created by admin on Mon Mar 31 23:35:17 GMT 2025 , Edited by admin on Mon Mar 31 23:35:17 GMT 2025

PRIMARY

CAS

174227-14-6

Created by admin on Mon Mar 31 23:35:17 GMT 2025 , Edited by admin on Mon Mar 31 23:35:17 GMT 2025

PRIMARY

RS_ITEM_NUM

1076137

Created by admin on Mon Mar 31 23:35:17 GMT 2025 , Edited by admin on Mon Mar 31 23:35:17 GMT 2025

PRIMARY

Related Record Type Details


					Q326023R30

BOSENTAN

PARENT -> IMPURITY

Amount: