Tert-butyl 4-[[2-fluoro-4-(methylamino)phenyl]methyl]-2-methylpiperazine-1-carboxylate → HCID 178430337, compound
Reaction equation
[Cl:25][c:26]1[cH:27][cH:28][c:29]([C:32](=[O:33])[N:34]([c:35]2[cH:36][cH:37][c:38]([CH2:41][N:42]3[CH2:43][CH:44]([CH3:55])[N:45]([C:48](=[O:49])[O:50][C:51]([CH3:52])([CH3:53])[CH3:54])[CH2:46][CH2:47]3)[cH:39][cH:40]2)[CH3:56])[cH:30][n:31]1.[F:1][c:2]1[cH:3][c:4]([NH:5][CH3:6])[cH:7][cH:8][c:9]1[CH2:10][N:11]1[CH2:12][CH2:13][N:14]([C:15]([O:16][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:21])[CH:22]([CH3:23])[CH2:24]1>>[F:1][c:40]1[c:35]([N:34]([C:32]([c:29]2[cH:28][cH:27][c:26]([Cl:25])[n:31][cH:30]2)=[O:33])[CH3:56])[cH:36][cH:37][c:38]([CH2:41][N:42]2[CH2:43][CH:44]([CH3:55])[N:45]([C:48](=[O:49])[O:50][C:51]([CH3:52])([CH3:53])[CH3:54])[CH2:46][CH2:47]2)[cH:39]1Participants
3
Sources & evidence
- ORD record
- ord-4d26885d48c24e2487bd8679c4bace41
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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