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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H16N2O4S
Molecular Weight 308.353
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(AZEPAN-1-YLSULFONYL)-1H-INDOLE-2,3-DIONE

SMILES

O=C1NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)C1=O

InChI

InChIKey=MLWAHVYFMDBXBL-UHFFFAOYSA-N
InChI=1S/C14H16N2O4S/c17-13-11-9-10(5-6-12(11)15-14(13)18)21(19,20)16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8H2,(H,15,17,18)

HIDE SMILES / InChI

Molecular Formula C14H16N2O4S
Molecular Weight 308.353
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 Wed Apr 02 08:00:31 GMT 2025
Edited
by admin
on Wed Apr 02 08:00:31 GMT 2025
Record UNII
FZJ9W3Z6PZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-AZEPINE, 1-((2,3-DIHYDRO-2,3-DIOXO-1H-INDOL-5-YL)SULFONYL)HEXAHYDRO-
Preferred Name English
5-(AZEPAN-1-YLSULFONYL)-1H-INDOLE-2,3-DIONE
Systematic Name English
1H-INDOLE-2,3-DIONE, 5-((HEXAHYDRO-1H-AZEPIN-1-YL)SULFONYL)-
Systematic Name English
5-(AZEPANE-1-SULFONYL)-2,3-DIHYDRO-1H-INDOLE-2,3-DIONE
Systematic Name English
Code System Code Type Description
PUBCHEM
9839586
Created by admin on Wed Apr 02 08:00:31 GMT 2025 , Edited by admin on Wed Apr 02 08:00:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID20431675
Created by admin on Wed Apr 02 08:00:31 GMT 2025 , Edited by admin on Wed Apr 02 08:00:31 GMT 2025
PRIMARY
CAS
220510-14-5
Created by admin on Wed Apr 02 08:00:31 GMT 2025 , Edited by admin on Wed Apr 02 08:00:31 GMT 2025
PRIMARY
FDA UNII
FZJ9W3Z6PZ
Created by admin on Wed Apr 02 08:00:31 GMT 2025 , Edited by admin on Wed Apr 02 08:00:31 GMT 2025
PRIMARY