Propane-bis-methyloxime-isoquinolinium-cpd17

General

Type : Oxime, Bisoxime, Isoquinoline

Chemical_Nomenclature : 2,2-(Propane-1,3-diyl)bis(5-((hydroxyimino)methyl)isoquinolin-2-ium) bromide

Canonical SMILES : C1(=CC=CC2=C1C=C[N+](=C2)CCC[N+]3=CC4=C(C=C3)C(=CC=C4)C=NO)C=NO.[Br-].[Br-]

InChI : InChI=1S\/C23H20N4O2.2BrH\/c28-24-14-18-4-1-6-20-16-26(12-8-22(18)20)10-3-11-27-13-9-23-19(15-25-29)5-2-7-21(23)17-27\;\;\/h1-2,4-9,12-17H,3,10-11H2\;2*1H

InChIKey : NVYHGAYSQLMLSS-UHFFFAOYSA-N

Other name(s) : cpd 17


MW : 546.26

Formula : C23H22Br2N4O2

CAS_number :

PubChem :

UniChem : NVYHGAYSQLMLSS-UHFFFAOYSA-N

Target

Structure : No structure

Families : No family

References (1)

Title : Synthesis, in vitro screening and molecular docking of isoquinolinium-5-carbaldoximes as acetylcholinesterase and butyrylcholinesterase reactivators - Malinak_2020_J.Enzyme.Inhib.Med.Chem_35_478
Author(s) : Malinak D , Dolezal R , Hepnarova V , Hozova M , Andrys R , Bzonek P , Racakova V , Korabecny J , Gorecki L , Mezeiova E , Psotka M , Jun D , Kuca K , Musilek K
Ref : J Enzyme Inhib Med Chem , 35 :478 , 2020
Abstract :
PubMedSearch : Malinak_2020_J.Enzyme.Inhib.Med.Chem_35_478
PubMedID: 31910701