Hydrochloric Acid → {2-Oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-carbamic acid tert-butyl ester
Reaction equation
[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][CH2:18][C:19](=[O:20])[OH:21].[CH3:22][CH2:23][N:24]=[C:25]=[N:26][CH2:27][CH2:28][CH2:29][N:30]([CH3:31])[CH3:32].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:43].[N:44]1([C:50](=[O:51])[c:52]2[c:53]([C:58]([F:59])([F:60])[F:61])[cH:54][cH:55][cH:56][cH:57]2)[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]1.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH2:67].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][CH2:18][C:19](=[O:21])[N:47]1[CH2:46][CH2:45][N:44]([C:50](=[O:51])[c:52]2[c:53]([C:58]([F:59])([F:60])[F:61])[cH:54][cH:55][cH:56][cH:57]2)[CH2:49][CH2:48]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-f5e7437b33c94e30a583f906d68aefa4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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