CHEMBL3087807
General
Type : Sulfonamide,Sulfur Compound
Chemical_Nomenclature : N-[2-(diethylamino)ethyl]-1-(4-fluorophenyl)methanesulfonamide
Canonical SMILES : CCN(CC)CCNS(=O)(=O)CC1=CC=C(C=C1)F
InChI : InChI=1S\/C13H21FN2O2S\/c1-3-16(4-2)10-9-15-19(17,18)11-12-5-7-13(14)8-6-12\/h5-8,15H,3-4,9-11H2,1-2H3
InChIKey : UKOZIEJMLUYTMK-UHFFFAOYSA-N
Other name(s) : BDBM50443047,N-[2-(Diethylamino)ethyl]-1-(4-Fluorophenyl)methanesulfonamide
MW : 288.38
Formula : C13H21FN2O2S
CAS_number :
PubChem : 71677772
UniChem : UKOZIEJMLUYTMK-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : CHEMBL3087807 ligand of proteins in family: ACHE
Stucture : 4B80 Mus musculus Acetylcholinesterase in complex with N-(2-Diethylamino- ethyl)-C-(4-fluoro-phenyl)-methanesulfonamide
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 |