U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H16N2O5S2
Molecular Weight 428.481
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,7-Bis(p-tolylsulfonyl)benzofurazan

SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C3=NON=C23)S(=O)(=O)C4=CC=C(C)C=C4

InChI

InChIKey=POUINNGRIOLASW-UHFFFAOYSA-N
InChI=1S/C20H16N2O5S2/c1-13-3-7-15(8-4-13)28(23,24)17-11-12-18(20-19(17)21-27-22-20)29(25,26)16-9-5-14(2)6-10-16/h3-12H,1-2H3

HIDE SMILES / InChI

Molecular Formula C20H16N2O5S2
Molecular Weight 428.481
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 Tue Apr 01 19:43:48 GMT 2025
Edited
by admin
on Tue Apr 01 19:43:48 GMT 2025
Record UNII
VM6LU97UKW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-228156
Preferred Name English
4,7-Bis(p-tolylsulfonyl)benzofurazan
Systematic Name English
Benzofurazan, 4,7-bis(p-tolylsulfonyl)-
Systematic Name English
4,7-Bis[(4-methylphenyl)sulfonyl]-2,1,3-benzoxadiazole
Systematic Name English
2,1,3-Benzoxadiazole, 4,7-bis[(4-methylphenyl)sulfonyl]-
Systematic Name English
Benzofurazan, 4,7-bis((4-methylphenyl)sulfonyl)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30202156
Created by admin on Tue Apr 01 19:43:48 GMT 2025 , Edited by admin on Tue Apr 01 19:43:48 GMT 2025
PRIMARY
NSC
228156
Created by admin on Tue Apr 01 19:43:48 GMT 2025 , Edited by admin on Tue Apr 01 19:43:48 GMT 2025
PRIMARY
CAS
53886-93-4
Created by admin on Tue Apr 01 19:43:48 GMT 2025 , Edited by admin on Tue Apr 01 19:43:48 GMT 2025
PRIMARY
PUBCHEM
40916
Created by admin on Tue Apr 01 19:43:48 GMT 2025 , Edited by admin on Tue Apr 01 19:43:48 GMT 2025
PRIMARY
FDA UNII
VM6LU97UKW
Created by admin on Tue Apr 01 19:43:48 GMT 2025 , Edited by admin on Tue Apr 01 19:43:48 GMT 2025
PRIMARY