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Details

Stereochemistry ACHIRAL
Molecular Formula C29H22N8O7S2
Molecular Weight 658.664
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 2-HYDROXY-3,5-BIS(2-(4-(PYRIDIN-2-YLSULFAMOYL)PHENYL)DIAZENYL)BENZOIC ACID

SMILES

OC(=O)C1=CC(=CC(\N=N\C2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=C3)=C1O)\N=N\C4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=C5

InChI

InChIKey=XUCGEVUEJYLZHM-XUXOKTBYSA-N
InChI=1S/C29H22N8O7S2/c38-28-24(29(39)40)17-21(34-32-19-7-11-22(12-8-19)45(41,42)36-26-5-1-3-15-30-26)18-25(28)35-33-20-9-13-23(14-10-20)46(43,44)37-27-6-2-4-16-31-27/h1-18,38H,(H,30,36)(H,31,37)(H,39,40)/b34-32+,35-33+

HIDE SMILES / InChI

Molecular Formula C29H22N8O7S2
Molecular Weight 658.664
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:36:40 UTC 2023
Edited
by admin
on Sat Dec 16 08:36:40 UTC 2023
Record UNII
96255OEK8L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-HYDROXY-3,5-BIS(2-(4-(PYRIDIN-2-YLSULFAMOYL)PHENYL)DIAZENYL)BENZOIC ACID
Systematic Name English
BENZOIC ACID, 2-HYDROXY-3,5-BIS(2-(4-((2-PYRIDINYLAMINO)SULFONYL)PHENYL)DIAZENYL)-
Systematic Name English
SULFASALAZINE IMPURITY B [EP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
96255OEK8L
Created by admin on Sat Dec 16 08:36:40 UTC 2023 , Edited by admin on Sat Dec 16 08:36:40 UTC 2023
PRIMARY
CAS
1391062-49-9
Created by admin on Sat Dec 16 08:36:40 UTC 2023 , Edited by admin on Sat Dec 16 08:36:40 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
72942035
Created by admin on Sat Dec 16 08:36:40 UTC 2023 , Edited by admin on Sat Dec 16 08:36:40 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP