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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H4N4
Molecular Weight 144.1335
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-CYANOBENZOTRIAZOLE

SMILES

N#CN1N=NC2=C1C=CC=C2

InChI

InChIKey=JPUHPGALPBINPO-UHFFFAOYSA-N
InChI=1S/C7H4N4/c8-5-11-7-4-2-1-3-6(7)9-10-11/h1-4H

HIDE SMILES / InChI

Approval Year

Name Type Language
1-CYANOBENZOTRIAZOLE [MI]
Preferred Name English
1-CYANOBENZOTRIAZOLE
MI  
Systematic Name English
1H-BENZOTRIAZOLE-1-CARBONITRILE
Systematic Name English
Code System Code Type Description
CAS
15328-32-2
Created by admin on Mon Mar 31 22:38:50 GMT 2025 , Edited by admin on Mon Mar 31 22:38:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID10357577
Created by admin on Mon Mar 31 22:38:50 GMT 2025 , Edited by admin on Mon Mar 31 22:38:50 GMT 2025
PRIMARY
FDA UNII
29GTR2N38B
Created by admin on Mon Mar 31 22:38:50 GMT 2025 , Edited by admin on Mon Mar 31 22:38:50 GMT 2025
PRIMARY
PUBCHEM
854385
Created by admin on Mon Mar 31 22:38:50 GMT 2025 , Edited by admin on Mon Mar 31 22:38:50 GMT 2025
PRIMARY
MERCK INDEX
m3950
Created by admin on Mon Mar 31 22:38:50 GMT 2025 , Edited by admin on Mon Mar 31 22:38:50 GMT 2025
PRIMARY Merck Index