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Details

Stereochemistry ACHIRAL
Molecular Formula C6H6N4
Molecular Weight 134.1386
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-AMINOBENZOTRIAZOLE

SMILES

NN1N=NC2=C1C=CC=C2

InChI

InChIKey=JCXKHYLLVKZPKE-UHFFFAOYSA-N
InChI=1S/C6H6N4/c7-10-6-4-2-1-3-5(6)8-9-10/h1-4H,7H2

HIDE SMILES / InChI

Molecular Formula C6H6N4
Molecular Weight 134.1386
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
450.0 nM [IC50]
Substance Class Chemical
Created
by admin
on Tue Apr 01 19:43:04 GMT 2025
Edited
by admin
on Tue Apr 01 19:43:04 GMT 2025
Record UNII
9EFF75BJ1O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-114498
Preferred Name English
1-AMINOBENZOTRIAZOLE
Systematic Name English
1H-BENZOTRIAZOLE, 1-AMINO-
Systematic Name English
3-AMINOBENZOTRIAZOLE
Systematic Name English
1H-BENZO(D)(1,2,3)TRIAZOL-1-AMINE
Systematic Name English
1-AMINO-1,2,3-BENZOTRIAZOLE
Systematic Name English
1H-BENZOTRIAZOL-1-AMINE
Systematic Name English
1-BENZOTRIAZOLYLAMINE
Systematic Name English
Code System Code Type Description
FDA UNII
9EFF75BJ1O
Created by admin on Tue Apr 01 19:43:04 GMT 2025 , Edited by admin on Tue Apr 01 19:43:04 GMT 2025
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EPA CompTox
DTXSID80167140
Created by admin on Tue Apr 01 19:43:04 GMT 2025 , Edited by admin on Tue Apr 01 19:43:04 GMT 2025
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NSC
114498
Created by admin on Tue Apr 01 19:43:04 GMT 2025 , Edited by admin on Tue Apr 01 19:43:04 GMT 2025
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PUBCHEM
1367
Created by admin on Tue Apr 01 19:43:04 GMT 2025 , Edited by admin on Tue Apr 01 19:43:04 GMT 2025
PRIMARY
CAS
1614-12-6
Created by admin on Tue Apr 01 19:43:04 GMT 2025 , Edited by admin on Tue Apr 01 19:43:04 GMT 2025
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