X20348
General
Type : Oxadiazol, Sulfur Compound, Sulfonamide
Chemical_Nomenclature : N-{(2S,3S)-4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-3-hydroxy-1-phenylbutan-2-yl}-4-(2-methylbutan-2-yl)benzene-1-sulfonamide
Canonical SMILES : CCC(C)(C)c1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)[C@H](Cc3nc(no3)N(C)C)O
InChI : InChI=1S\/C25H34N4O4S\/c1-6-25(2,3)19-12-14-20(15-13-19)34(31,32)28-21(16-18-10-8-7-9-11-18)22(30)17-23-26-24(27-33-23)29(4)5\/h7-15,21-22,28,30H,6,16-17H2,1-5H3\/t21-,22-\/m0\/s1
InChIKey : MDDQVOFJDJRHHJ-VXKWHMMOSA-N
Other name(s) : ~{N}-[(2~{S},3~{S})-4-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]-3-oxidanyl-1-phenyl-butan-2-yl]-4-(2-methylbutan-2-yl)benzenesulfonamide || QU0
Target
References (1)
| Title : Inhibitors of the Thioesterase Activity of Mycobacterium tuberculosis Pks13 Discovered Using DNA-Encoded Chemical Library Screening - Krieger_2024_ACS.Infect.Dis__ |
| Author(s) : Krieger IV , Yalamanchili S , Dickson P , Engelhart CA , Zimmerman MD , Wood J , Clary E , Nguyen J , Thornton N , Centrella PA , Chan B , Cuozzo JW , Gengenbacher M , Guie MA , Guilinger JP , Bienstock C , Hartl H , Hupp CD , Jetson R , Satoh T , Yeoman JTS , Zhang Y , Dartois V , Schnappinger D , Keefe AD , Sacchettini JC |
| Ref : ACS Infect Dis , : , 2024 |
| Abstract : |
| PubMedSearch : Krieger_2024_ACS.Infect.Dis__ |
| PubMedID: 38577994 |