CHEMBL3087815

General

Type : Trifluoro, Sulfur Compound, Sulfonamide, Benzenesulfonamide

Chemical_Nomenclature : N-[2-(diethylamino)ethyl]-3-(trifluoromethyl)benzenesulfonamide

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

InChI : InChI=1S\/C13H19F3N2O2S\/c1-3-18(4-2)9-8-17-21(19,20)12-7-5-6-11(10-12)13(14,15)16\/h5-7,10,17H,3-4,8-9H2,1-2H3

InChIKey : LCVUXYUASXEIMC-UHFFFAOYSA-N

Other name(s) : BDBM50443028  ||  N-[2-(Diethylamino)ethyl]-3-(Trifluoromethyl)benzenesulfonamide  ||  Z5K


MW : 324.36

Formula : C13H19F3N2O2S

CAS_number :

PubChem : 71677775

UniChem : LCVUXYUASXEIMC-UHFFFAOYSA-N

Target

Families : CHEMBL3087815 ligand of proteins in family
ACHE

Structure :
4B84

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