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Details

Stereochemistry ACHIRAL
Molecular Formula C16H16N6
Molecular Weight 292.3384
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Benzenemethanamine, N-methyl-N-[4-(1H-1,2,4-triazol-3-ylazo)phenyl]-

SMILES

CN(CC1=CC=CC=C1)C2=CC=C(C=C2)\N=N\C3=NC=NN3

InChI

InChIKey=FZGDYRXFIQRRDI-XUTLUUPISA-N
InChI=1S/C16H16N6/c1-22(11-13-5-3-2-4-6-13)15-9-7-14(8-10-15)19-21-16-17-12-18-20-16/h2-10,12H,11H2,1H3,(H,17,18,20)/b21-19+

HIDE SMILES / InChI

Molecular Formula C16H16N6
Molecular Weight 292.3384
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:48:05 GMT 2025
Edited
by admin
on Tue Apr 01 17:48:05 GMT 2025
Record UNII
YQ3BC6BZE8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenemethanamine, N-methyl-N-[4-[2-(1H-1,2,4-triazol-5-yl)diazenyl]phenyl]-
Preferred Name English
Benzenemethanamine, N-methyl-N-[4-(1H-1,2,4-triazol-3-ylazo)phenyl]-
Systematic Name English
N-Methyl-N-[4-[2-(1H-1,2,4-triazol-5-yl)diazenyl]phenyl]benzenemethanamine
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID8069228
Created by admin on Tue Apr 01 17:48:05 GMT 2025 , Edited by admin on Tue Apr 01 17:48:05 GMT 2025
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CAS
58104-38-4
Created by admin on Tue Apr 01 17:48:05 GMT 2025 , Edited by admin on Tue Apr 01 17:48:05 GMT 2025
PRIMARY
PUBCHEM
93954
Created by admin on Tue Apr 01 17:48:05 GMT 2025 , Edited by admin on Tue Apr 01 17:48:05 GMT 2025
PRIMARY
FDA UNII
YQ3BC6BZE8
Created by admin on Tue Apr 01 17:48:05 GMT 2025 , Edited by admin on Tue Apr 01 17:48:05 GMT 2025
PRIMARY
ECHA (EC/EINECS)
261-125-6
Created by admin on Tue Apr 01 17:48:05 GMT 2025 , Edited by admin on Tue Apr 01 17:48:05 GMT 2025
PRIMARY