CHEMBL1624646

CHEMBL1624646 is the chloride derivative of CHEMBL3087806

General

Type : Sulfur Compound, Sulfonamide, Benzenesulfonamide

Chemical_Nomenclature : 4-chloro-N-[2-(diethylamino)ethyl]benzenesulfonamide

Canonical SMILES : CCN(CC)CCNS(=O)(=O)C1=CC=C(C=C1)Cl

InChI : InChI=1S\/C12H19ClN2O2S\/c1-3-15(4-2)10-9-14-18(16,17)12-7-5-11(13)6-8-12\/h5-8,14H,3-4,9-10H2,1-2H3

InChIKey : KVQQWVRVJDYYMC-UHFFFAOYSA-N

Other name(s) : Compound-17  ||  BRN 3356406  ||  Benzenesulfonamide, p-chloro-N-(2-diethylaminoethyl)-  ||  32411-07-7  ||  p-Chloro-N-(2-diethylaminoethyl)benzenesulfonamide  ||  4-chloro-n-[2-(diethylamino)ethyl]benzenesulfonamide


MW : 290.80

Formula : C12H19ClN2O2S

CAS_number :

PubChem : 208542

UniChem : KVQQWVRVJDYYMC-UHFFFAOYSA-N

Target

Families : CHEMBL1624646 ligand of proteins in family
ACHE

Structure :
4B85

Protein :
mouse-ACHE

References (1)

Title : Divergent Structure-Activity Relationships of Structurally Similar Acetylcholinesterase Inhibitors - Andersson_2013_J.Med.Chem_56_7615
Author(s) : Andersson CD , Forsgren N , Akfur C , Allgardsson A , Berg L , Engdahl C , Qian W , Ekstrom F , Linusson A
Ref : Journal of Medicinal Chemistry , 56 :7615 , 2013
Abstract :
PubMedSearch : Andersson_2013_J.Med.Chem_56_7615
PubMedID: 23984975
Gene_locus related to this paper: mouse-ACHE