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
IUPHAR :
Wikipedia :
Target
Families : CHEMBL3087815 ligand of proteins in family: ACHE
Stucture : 4B84 Mus musculus Acetylcholinesterase in complex with N-(2-Diethylamino- ethyl)-3-trifluoromethyl-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 |