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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H16ClN3O3S
Molecular Weight 317.792
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DABUZALGRON

SMILES

CC1=C(NS(C)(=O)=O)C(Cl)=CC=C1OCC2=NCCN2

InChI

InChIKey=FOYWMEJSRSBQGB-UHFFFAOYSA-N
InChI=1S/C12H16ClN3O3S/c1-8-10(19-7-11-14-5-6-15-11)4-3-9(13)12(8)16-20(2,17)18/h3-4,16H,5-7H2,1-2H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H16ClN3O3S
Molecular Weight 317.792
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 Fri Dec 15 16:21:48 UTC 2023
Edited
by admin
on Fri Dec 15 16:21:48 UTC 2023
Record UNII
LGX4GZ74WO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DABUZALGRON
INN  
INN  
Official Name English
N-(6-CHLORO-3-(4,5-DIHYDRO-1H-IMIDAZOL-2-YLMETHOXY)-2-METHYLPHENYL)METHANESULFONAMIDE
Systematic Name English
METHANESULFONAMIDE, N-(6-CHLORO-3-((4,5-DIHYDRO-1H-IMIDAZOL-2-YL)METHOXY)-2-METHYLPHENYL)-
Systematic Name English
dabuzalgron [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29709
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
Code System Code Type Description
CAS
219311-44-1
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
EPA CompTox
DTXSID50176345
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
SMS_ID
100000184090
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
PUBCHEM
216249
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
INN
8386
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
CHEBI
142452
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
MESH
C481520
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
FDA UNII
LGX4GZ74WO
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
ChEMBL
CHEMBL257978
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
NCI_THESAURUS
C75036
Created by admin on Fri Dec 15 16:21:48 UTC 2023 , Edited by admin on Fri Dec 15 16:21:48 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY