2-allyl-4-oxocyclobutyl-4-methylbenzenesulfonamide

General

Type : Sulfur Compound,Sulfonamide,Benzenesulfonamide

Chemical_Nomenclature : N-((1R,2S)-2-allyl-4-oxocyclobutyl)-4-methylbenzenesulfonamide

Canonical SMILES : Cc1ccc(cc1)S(=O)(=O)N[C@H]1[C@@H](O)C[C@@H]1CC=C

InChI : InChI=1S\/C14H19NO3S\/c1-3-4-11-9-13(16)14(11)15-19(17,18)12-7-5-10(2)6-8-12\/h3,5-8,11,13-16H,1,4,9H2,2H3\/t11-,13-,14+\/m0\/s1

InChIKey : KFIWUGSQQLTLIY-FPMFFAJLSA-N

Other name(s) : 4-methyl-N-[(1R,2S,4S)-2-oxidanyl-4-prop-2-enyl-cyclobutyl]benzenesulfonamide,0S1,ZINC000098207858


MW : 281.37

Formula : C14H19NO3S

CAS_number :

PubChem : 137347887

UniChem : KFIWUGSQQLTLIY-FPMFFAJLSA-N

IUPHAR :

Wikipedia :

Target

Families : 2-allyl-4-oxocyclobutyl-4-methylbenzenesulfonamide ligand of proteins in family: LYsophospholipase_carboxylesterase

Stucture : 4F21 Crystal structure of carboxylesterase\/phospholipase family protein from Francisella tularensis

Protein : fratt-q5ni32

References (1)

Title : Large-scale structural rearrangement of a serine hydrolase from Francisella tularensis facilitates catalysis - Filippova_2013_J.Biol.Chem_288_10522
Author(s) : Filippova EV , Weston LA , Kuhn ML , Geissler B , Gehring AM , Armoush N , Adkins CT , Minasov G , Dubrovska I , Shuvalova L , Winsor JR , Lavis LD , Satchell KJ , Becker DP , Anderson WF , Johnson RJ
Ref : Journal of Biological Chemistry , 288 :10522 , 2013
Abstract : Filippova_2013_J.Biol.Chem_288_10522
ESTHER : Filippova_2013_J.Biol.Chem_288_10522
PubMedSearch : Filippova_2013_J.Biol.Chem_288_10522
PubMedID: 23430251
Gene_locus related to this paper: fratt-q5ni32