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Details

Stereochemistry ACHIRAL
Molecular Formula C14H11N5O5
Molecular Weight 329.2676
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(1,3-BENZODIOXOL-5-YL)-1,6-DIMETHYLPYRIMIDO(5,4-E)(1,2,4)TRIAZINE-5,7(1H,6H)-DIONE 4-OXIDE

SMILES

CN1N=C(C2=CC3=C(OCO3)C=C2)N(=O)=C4C(=O)N(C)C(=O)N=C14

InChI

InChIKey=NMUZICGNWZUGMK-UHFFFAOYSA-N
InChI=1S/C14H11N5O5/c1-17-13(20)10-12(15-14(17)21)18(2)16-11(19(10)22)7-3-4-8-9(5-7)24-6-23-8/h3-5H,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H11N5O5
Molecular Weight 329.2676
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 Sat Dec 16 12:37:40 GMT 2023
Edited
by admin
on Sat Dec 16 12:37:40 GMT 2023
Record UNII
8Z96H5DVR7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(1,3-BENZODIOXOL-5-YL)-1,6-DIMETHYLPYRIMIDO(5,4-E)(1,2,4)TRIAZINE-5,7(1H,6H)-DIONE 4-OXIDE
Systematic Name English
NSC-280177
Code English
PYRIMIDO(5,4-E)-1,2,4-TRIAZINE-5,7(1H,6H)-DIONE, 3-(1,3-BENZODIOXOL-5-YL)-1,6-DIMETHYL-, 4-OXIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70206198
Created by admin on Sat Dec 16 12:37:40 GMT 2023 , Edited by admin on Sat Dec 16 12:37:40 GMT 2023
PRIMARY
CAS
57562-66-0
Created by admin on Sat Dec 16 12:37:40 GMT 2023 , Edited by admin on Sat Dec 16 12:37:40 GMT 2023
PRIMARY
NSC
280177
Created by admin on Sat Dec 16 12:37:40 GMT 2023 , Edited by admin on Sat Dec 16 12:37:40 GMT 2023
PRIMARY
PUBCHEM
322481
Created by admin on Sat Dec 16 12:37:40 GMT 2023 , Edited by admin on Sat Dec 16 12:37:40 GMT 2023
PRIMARY
FDA UNII
8Z96H5DVR7
Created by admin on Sat Dec 16 12:37:40 GMT 2023 , Edited by admin on Sat Dec 16 12:37:40 GMT 2023
PRIMARY