1-[4-(3-chloro-2,4,6-trifluorophenyl)sulfonyl-1-piperazinyl]ethanone

Properties Image MNX_ID MNXM341007 reference chebi:105494 formula C12H12ClF3N2O3S global charge 0 mol weight 356.753 InChIKey NJTIJFAEEKEFSS-UHFFFAOYSA-N InChI InChI=1S/C12H12ClF3N2O3S/c1-7(19)17-2-4-18(5-3-17)22(20,21)12-9(15)6-8(14)10(13)11(12)16/h6H,2-5H2,1H3 SMILES CC(=O)N1CCN(S(=O)(=O)C2=C(F)C(Cl)=C(F)C=C2F)CC1 MNX internals InChI (mnx) InChI=1/C12H12ClF3N2O3S/c1-7(19)17-2-4-18(5-3-17)22(20,21)12-9(15)6-8(14)10(13)11(12)16/h6H,2-5H2,1H3 SMILES (mnx) [CH3:1][C:7]([N:17]1[CH2:2][CH2:4][N:18]([S:22]([C:12]2=[C:9]([F:15])[CH:6]=[C:8]([F:14])[C:10]([Cl:13])=[C:11]2[F:16])(=[O:20])=[O:21])[CH2:5][CH2:3]1)=[O:19]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0