EA-3148

General

Type : Chemical Warfare Agent,Organophosphate,Nerve Agent V-series,Sulfur Compound

Chemical_Nomenclature : 2-[cyclopentyloxy(methyl)phosphoryl]sulfanyl-N,N-diethylethanamine

Canonical SMILES : CCN(CC)CCSP(=O)(C)OC1CCCC1

InChI : InChI=1S\/C12H26NO2PS\/c1-4-13(5-2)10-11-17-16(3,14)15-12-8-6-7-9-12\/h12H,4-11H2,1-3H3

InChIKey : PMVOUPZOZITGTQ-UHFFFAOYSA-N

Other name(s) : AC1LBKSN,PMVOUPZOZITGTQ-UHFFFAOYSA-N,Methylphosphonothioic acid, o-cyclopentyl ester S-[2-(diethylamino)ethyl] ester,LS-107132,Substance 100A


MW : 279.37

Formula : C12H26NO2PS

CAS_number : 93240-66-5

PubChem : 559673

UniChem : PMVOUPZOZITGTQ-UHFFFAOYSA-N

IUPHAR :

Wikipedia : EA-3148

Target

Families : EA-3148 ligand of proteins in family: ACHE || BCHE

Stucture :

Protein :

References (2)

Title : The prediction of acute toxicity (LD(50)) for organophosphorus-based chemical warfare agents (V-series) using toxicology in silico methods - Noga_2023_Arch.Toxicol__
Author(s) : Noga M , Michalska A , Jurowski K
Ref : Archives of Toxicology , : , 2023
Abstract : Noga_2023_Arch.Toxicol__
ESTHER : Noga_2023_Arch.Toxicol__
PubMedSearch : Noga_2023_Arch.Toxicol__
PubMedID: 38051368

Title : Determination of the structural features of O-alkyl-S-2-(N,N-dialkylamino) ethyl alkylthiophosphonates from their electron ionization mass spectra - Terentyev_2016_J.Anal.Chem_71_1266
Author(s) : Terentyev AG , Morozik YI , Rybal'chenko IV , Dudkin AV , Smirnov AO , Galyaev GV
Ref : Journal of Analytical Chemistry , 71 :1266 , 2016
Abstract : Terentyev_2016_J.Anal.Chem_71_1266
ESTHER : Terentyev_2016_J.Anal.Chem_71_1266
PubMedSearch : Terentyev_2016_J.Anal.Chem_71_1266
PubMedID: