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Details

Stereochemistry ACHIRAL
Molecular Formula C4H3N5O2
Molecular Weight 153.0989
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-IMINO-2,3-DIHYDRO-1H-IMIDAZO(1,2-B)(1,2,4)TRIAZOLE-5,6-DIONE

SMILES

N=C1NN2C(=O)C(=O)N=C2N1

InChI

InChIKey=OBUBYXWLXRSLTH-UHFFFAOYSA-N
InChI=1S/C4H3N5O2/c5-3-7-4-6-1(10)2(11)9(4)8-3/h(H3,5,6,7,8,10)

HIDE SMILES / InChI

Molecular Formula C4H3N5O2
Molecular Weight 153.0989
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 Tue Apr 01 19:38:17 GMT 2025
Edited
by admin
on Tue Apr 01 19:38:17 GMT 2025
Record UNII
J3IOQ6CMG2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-177950
Preferred Name English
2-IMINO-2,3-DIHYDRO-1H-IMIDAZO(1,2-B)(1,2,4)TRIAZOLE-5,6-DIONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20192996
Created by admin on Tue Apr 01 19:38:17 GMT 2025 , Edited by admin on Tue Apr 01 19:38:17 GMT 2025
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NSC
177950
Created by admin on Tue Apr 01 19:38:17 GMT 2025 , Edited by admin on Tue Apr 01 19:38:17 GMT 2025
PRIMARY
PUBCHEM
301327
Created by admin on Tue Apr 01 19:38:17 GMT 2025 , Edited by admin on Tue Apr 01 19:38:17 GMT 2025
PRIMARY
FDA UNII
J3IOQ6CMG2
Created by admin on Tue Apr 01 19:38:17 GMT 2025 , Edited by admin on Tue Apr 01 19:38:17 GMT 2025
PRIMARY
CAS
39958-44-6
Created by admin on Tue Apr 01 19:38:17 GMT 2025 , Edited by admin on Tue Apr 01 19:38:17 GMT 2025
PRIMARY