4-methyl-3-nitrobenzamido-pentyl-1a
General
Type :
Chemical_Nomenclature : N-[3-(diethylamino)propyl]-4-methyl-3-nitrobenzamide
Canonical SMILES : CCN(CC)CCCNC(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]
InChI : InChI=1S\/C15H23N3O3\/c1-4-17(5-2)10-6-9-16-15(19)13-8-7-12(3)14(11-13)18(20)21\/h7-8,11H,4-6,9-10H2,1-3H3,(H,16,19)
InChIKey : ILLRGFMPSJAJDG-UHFFFAOYSA-N
Other name(s) : ZINC2744839,AKOS003276276,MCULE-6666634760
MW : 293.36
Formula : C15H23N3O3
CAS_number :
PubChem : 3268779
UniChem : ILLRGFMPSJAJDG-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : 4-methyl-3-nitrobenzamido-pentyl-1a ligand of proteins in family: ACHE
Stucture : 7R02 Mus musculus Acetylcholinesterase in complex with inhibitor 4-methyl-3-nitrobenzamido-pentyl-1a
Protein : mouse-ACHE
References (1)
| Title : Broad-spectrum antidote discovery by untangling the reactivation mechanism of nerve agent inhibited acetylcholinesterase - Lindgren_2022_Chemistry_28_e202200678 |
| Author(s) : Lindgren C , Forsgren N , Hoster N , Akfur C , Artursson E , Edvinsson L , Svensson R , Worek F , Ekstrom , Linusson A |
| Ref : Chemistry , 28 :e202200678 , 2022 |
| Abstract : Lindgren_2022_Chemistry_28_e202200678 |
| ESTHER : Lindgren_2022_Chemistry_28_e202200678 |
| PubMedSearch : Lindgren_2022_Chemistry_28_e202200678 |
| PubMedID: 35420233 |
| Gene_locus related to this paper: mouse-ACHE |