CHEMBL3087813
General
Type : Sulfur Compound,Sulfonamide,Sulfonyl,Benzenesulfonamide
Chemical_Nomenclature : N-[2-(diethylamino)ethyl]-2-fluorobenzenesulfonamide
Canonical SMILES : CCN(CC)CCNS(=O)(=O)C1=CC=CC=C1F
InChI : InChI=1S\/C12H19FN2O2S\/c1-3-15(4-2)10-9-14-18(16,17)12-8-6-5-7-11(12)13\/h5-8,14H,3-4,9-10H2,1-2H3
InChIKey : DWACGKNOPVYPHQ-UHFFFAOYSA-N
Other name(s) : AC1M23IP,ZINC2726126,BDBM50443043,AKOS008940863,MCULE-2152724809,AC1M23IM,Diethyl-[2-[(2-fluorophenyl)sulfonylamino]ethyl]azanium,B3Z
MW : 274.35
Formula : C12H19FN2O2S
CAS_number :
UniChem : DWACGKNOPVYPHQ-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : CHEMBL3087813 ligand of proteins in family: ACHE
Stucture : 4B82 Mus musculus Acetylcholinesterase in complex with N-(2-Diethylamino- ethyl)-2-fluoro-benzenesulfonamide
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 : Andersson_2013_J.Med.Chem_56_7615 |
| ESTHER : Andersson_2013_J.Med.Chem_56_7615 |
| PubMedSearch : Andersson_2013_J.Med.Chem_56_7615 |
| PubMedID: 23984975 |
| Gene_locus related to this paper: mouse-ACHE |