(2S)-2-[5-[(2,4-dichlorophenyl)methylthio]-1,3,4-oxadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester

Properties Image MNX_ID MNXM171143 reference chebi:121193 formula C18H21Cl2N3O3S global charge 0 mol weight 430.357 InChIKey JDZKHMFWSIVDHP-AWEZNQCLSA-N InChI InChI=1S/C18H21Cl2N3O3S/c1-18(2,3)26-17(24)23-8-4-5-14(23)15-21-22-16(25-15)27-10-11-6-7-12(19)9-13(11)20/h6-7,9,14H,4-5,8,10H2,1-3H3/t14-/m0/s1 SMILES CC(C)(C)OC(=O)N1CCC[C@H]1C1=NN=C(SCC2=C(Cl)C=C(Cl)C=C2)O1 MNX internals InChI (mnx) InChI=1/C18H21Cl2N3O3S/c1-18(2,3)26-17(24)23-8-4-5-14(23)15-21-22-16(25-15)27-10-11-6-7-12(19)9-13(11)20/h6-7,9,14H,4-5,8,10H2,1-3H3/t14-/m0/s1 SMILES (mnx) [CH3:1][C:18]([CH3:2])([CH3:3])[O:26][C:17]([N:23]1[CH2:8][CH2:4][CH2:5][C@H:14]1[C:15]1=[N:21][N:22]=[C:16]([S:27][CH2:10][C:11]2=[C:13]([Cl:20])[CH:9]=[C:12]([Cl:19])[CH:7]=[CH:6]2)[O:25]1)=[O:24]

Parent-child relations graph

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