Tert-butyl 7-amino-4,5-dihydro-1H-benzo[D]azepine-3(2H)-carboxylate → HCID 49838272, compound
Reaction equation
[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27](=[O:28])[N:29]1[CH2:30][CH2:31][c:32]2[c:33]([cH:36][cH:37][c:38]([NH2:40])[cH:39]2)[CH2:34][CH2:35]1.[Cl:1][c:2]1[n:3][n:4]2[c:5]([c:6](-[c:10]3[cH:11][cH:12][cH:13][c:14]4[c:18]3[O:17][C:16]([F:19])([F:20])[O:15]4)[cH:7][cH:8][cH:9]2)[n:21]1>>[c:2]1([NH:40][c:38]2[cH:37][cH:36][c:33]3[c:32]([cH:39]2)[CH2:31][CH2:30][N:29]([C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:28])[CH2:35][CH2:34]3)[n:3][n:4]2[c:5]([c:6](-[c:10]3[cH:11][cH:12][cH:13][c:14]4[c:18]3[O:17][C:16]([F:19])([F:20])[O:15]4)[cH:7][cH:8][cH:9]2)[n:21]1Participants
3
Sources & evidence
- ORD record
- ord-ae7bb240f2754d40b29173fab30136f5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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