Octyl-Benzisothiazolinone
General
Type : Thiazolinone,Sulfur Compound
Chemical_Nomenclature : 2-octyl-1,2-benzothiazol-3-one
Canonical SMILES : CCCCCCCCN1C(=O)C2=CC=CC=C2S1
InChI : InChI=1S\/C15H21NOS\/c1-2-3-4-5-6-9-12-16-15(17)13-10-7-8-11-14(13)18-16\/h7-8,10-11H,2-6,9,12H2,1H3
InChIKey : WVGPLHUTLSZSGX-UHFFFAOYSA-N
Other name(s) : BTZ-7,CHEMBL1922513,1,2-Benzisothiazol-3(2H)-one, 2-octyl-,ACMC-20n0gg,SCHEMBL1538479
MW : 263.4
Formula : C15H21NOS
CAS_number : 141426-19-9
PubChem : 18927006
UniChem : WVGPLHUTLSZSGX-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : Octyl-Benzisothiazolinone ligand of proteins in family: Monoglyceridelipase_lysophospholip
Stucture :
Protein : human-MGLL
References (2)
| Title : Benzisothiazolinone derivatives as potent allosteric monoacylglycerol lipase inhibitors that functionally mimic sulfenylation of regulatory cysteines - Castelli_2020_J.Med.Chem_63_1261 |
| Author(s) : Castelli R , Scalvini L , Vacondio F , Lodola A , Anselmi M , Vezzosi S , Carmi C , Bassi M , Ferlenghi F , Rivara S , Moller IR , Rand KD , Daglian J , Wei D , Dotsey EY , Ahmed F , Jung KM , Stella N , Singh S , Mor M , Piomelli D |
| Ref : Journal of Medicinal Chemistry , 63 :1261 , 2020 |
| Abstract : Castelli_2020_J.Med.Chem_63_1261 |
| ESTHER : Castelli_2020_J.Med.Chem_63_1261 |
| PubMedSearch : Castelli_2020_J.Med.Chem_63_1261 |
| PubMedID: 31714779 |
| Title : Benzisothiazolinone as a useful template for the design of new monoacylglycerol lipase inhibitors: investigation of the target residues and comparison with octhilinone - Matuszak_2011_Bioorg.Med.Chem.Lett_21_7321 |
| Author(s) : Matuszak N , Es Saadi B , Labar G , Marchand-Brynaert J , Lambert DM |
| Ref : Bioorganic & Medicinal Chemistry Lett , 21 :7321 , 2011 |
| Abstract : Matuszak_2011_Bioorg.Med.Chem.Lett_21_7321 |
| ESTHER : Matuszak_2011_Bioorg.Med.Chem.Lett_21_7321 |
| PubMedSearch : Matuszak_2011_Bioorg.Med.Chem.Lett_21_7321 |
| PubMedID: 22056744 |
| Gene_locus related to this paper: human-ABHD6 |