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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H19BrClN3O4
Molecular Weight 408.675
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-Bis(1,1-dimethylethyl) 2-(4-bromo-6-chloro-3-pyridazinyl)imidodicarbonate

SMILES

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1=NN=C(Cl)C=C1Br

InChI

InChIKey=OVIRUMFUQLQSJA-UHFFFAOYSA-N
InChI=1S/C14H19BrClN3O4/c1-13(2,3)22-11(20)19(12(21)23-14(4,5)6)10-8(15)7-9(16)17-18-10/h7H,1-6H3

HIDE SMILES / InChI

Molecular Formula C14H19BrClN3O4
Molecular Weight 408.675
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 Wed Apr 02 20:12:29 GMT 2025
Edited
by admin
on Wed Apr 02 20:12:29 GMT 2025
Record UNII
EHK2PK2J6H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-Bis(1,1-dimethylethyl) 2-(4-bromo-6-chloro-3-pyridazinyl)imidodicarbonate
Systematic Name English
Imidodicarbonic acid, 2-(4-bromo-6-chloro-3-pyridazinyl)-, 1,3-bis(1,1-dimethylethyl) ester
Preferred Name English
Code System Code Type Description
CAS
2845126-30-7
Created by admin on Wed Apr 02 20:12:29 GMT 2025 , Edited by admin on Wed Apr 02 20:12:29 GMT 2025
PRIMARY
FDA UNII
EHK2PK2J6H
Created by admin on Wed Apr 02 20:12:29 GMT 2025 , Edited by admin on Wed Apr 02 20:12:29 GMT 2025
PRIMARY
PUBCHEM
164886385
Created by admin on Wed Apr 02 20:12:29 GMT 2025 , Edited by admin on Wed Apr 02 20:12:29 GMT 2025
PRIMARY