(2-fluorophenyl)-[(2R,3R)-2-(hydroxymethyl)-1-methylsulfonyl-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]methanone

Properties Image MNX_ID MNXM170081 reference chebi:130248 formula C20H21FN2O4S global charge 0 mol weight 404.463 InChIKey WBKLPYUDVKUXGC-ZWKOTPCHSA-N InChI InChI=1S/C20H21FN2O4S/c1-28(26,27)23-17(11-24)18(14-7-3-2-4-8-14)20(23)12-22(13-20)19(25)15-9-5-6-10-16(15)21/h2-10,17-18,24H,11-13H2,1H3/t17-,18+/m0/s1 SMILES CS(=O)(=O)N1[C@@H](CO)[C@@H](C2=CC=CC=C2)C12CN(C(=O)C1=CC=CC=C1F)C2 MNX internals InChI (mnx) InChI=1/C20H21FN2O4S/c1-28(26,27)23-17(11-24)18(14-7-3-2-4-8-14)20(23)12-22(13-20)19(25)15-9-5-6-10-16(15)21/h2-10,17-18,24H,11-13H2,1H3/t17-,18+/m0/s1 SMILES (mnx) [CH3:1][S:28]([N:23]1[C@@H:17]([CH2:11][OH:24])[C@@H:18]([C:14]2=[CH:7][CH:3]=[CH:2][CH:4]=[CH:8]2)[C:20]12[CH2:12][N:22]([C:19]([C:15]1=[CH:9][CH:5]=[CH:6][CH:10]=[C:16]1[F:21])=[O:25])[CH2:13]2)(=[O:26])=[O:27]

Parent-child relations graph

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