Tert-butyl 7-amino-4,5-dihydro-1H-benzo[D]azepine-3(2H)-carboxylate → HCID 59612330, compound
Reaction equation
[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31](=[O:32])[N:33]1[CH2:34][CH2:35][c:36]2[c:37]([cH:40][cH:41][c:42]([NH2:44])[cH:43]2)[CH2:38][CH2:39]1.[Cl:1][c:2]1[n:3][n:4]2[c:5]([c:6](-[c:10]3[c:11]([O:20][CH2:21][CH:22]([F:23])[F:24])[cH:12][cH:13][c:14]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:15]3)[cH:7][cH:8][cH:9]2)[n:25]1>>[c:2]1([NH:44][c:42]2[cH:41][cH:40][c:37]3[c:36]([cH:43]2)[CH2:35][CH2:34][N:33]([C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:32])[CH2:39][CH2:38]3)[n:3][n:4]2[c:5]([c:6](-[c:10]3[c:11]([O:20][CH2:21][CH:22]([F:23])[F:24])[cH:12][cH:13][c:14]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:15]3)[cH:7][cH:8][cH:9]2)[n:25]1Participants
3
Sources & evidence
- ORD record
- ord-d52f6a31d72f496f818cbf7ceaf88abb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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