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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3N3O2S
Molecular Weight 181.172
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Nitro-2,1,3-benzothiadiazole

SMILES

[O-][N+](=O)C1=CC2=NSN=C2C=C1

InChI

InChIKey=BXZPSERJJMAPSV-UHFFFAOYSA-N
InChI=1S/C6H3N3O2S/c10-9(11)4-1-2-5-6(3-4)8-12-7-5/h1-3H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
5-Nitro-2,1,3-benzothiadiazole
Systematic Name English
NSC-169218
Preferred Name English
5-(Hydroxy(oxido)amino)-2,1,3-benzothiadiazole
Systematic Name English
2,1,3-Benzothiadiazole, 5-nitro-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60167385
Created by admin on Tue Apr 01 20:22:42 GMT 2025 , Edited by admin on Tue Apr 01 20:22:42 GMT 2025
PRIMARY
NSC
169218
Created by admin on Tue Apr 01 20:22:42 GMT 2025 , Edited by admin on Tue Apr 01 20:22:42 GMT 2025
PRIMARY
PUBCHEM
297897
Created by admin on Tue Apr 01 20:22:42 GMT 2025 , Edited by admin on Tue Apr 01 20:22:42 GMT 2025
PRIMARY
FDA UNII
K2T9C5FVT8
Created by admin on Tue Apr 01 20:22:42 GMT 2025 , Edited by admin on Tue Apr 01 20:22:42 GMT 2025
PRIMARY
CAS
16252-88-3
Created by admin on Tue Apr 01 20:22:42 GMT 2025 , Edited by admin on Tue Apr 01 20:22:42 GMT 2025
PRIMARY
NIH
NCATS
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