Hydrochloric Acid → 1-(4-Tert-butylbenzoyl)-4-(2,5-difluoro-4-methoxyphenyl)piperazine
Reaction equation
[C:17]([Cl:18])(=[O:19])[CH2:20][CH:21]([CH3:22])[CH3:23].[C:40]([CH3:41])([CH3:42])([CH3:43])[c:44]1[cH:45][cH:46][c:47]([C:48](=[O:49])[Cl:50])[cH:51][cH:52]1.[CH3:3][O:4][c:5]1[cH:6][cH:7][c:8]([N:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[cH:15][cH:16]1.[ClH:1].[ClH:2].[F:24][c:25]1[c:26]([N:34]2[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]2)[cH:27][c:28]([F:33])[c:29]([O:31][CH3:32])[cH:30]1>>[F:24][c:25]1[c:26]([N:34]2[CH2:35][CH2:36][N:37]([C:48]([c:47]3[cH:46][cH:45][c:44]([C:40]([CH3:41])([CH3:42])[CH3:43])[cH:52][cH:51]3)=[O:49])[CH2:38][CH2:39]2)[cH:27][c:28]([F:33])[c:29]([O:31][CH3:32])[cH:30]1Participants
6
Sources & evidence
- ORD record
- ord-a81944fffb6a454dafd22548315fe13c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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