Benzoic acid, 2-amino-3-chloro-, methyl ester → Isopropyl 5-[acetyl-(3,5-bistrifluoromethylbenzyl)amino]-9-chloro-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylate
Reaction equation
[CH:13]([CH3:14])([CH3:15])[O:16][C:17](=[O:18])[N:19]1[c:20]2[c:21]([cH:45][cH:46][cH:47][cH:48]2)[CH:22]([N:26]([CH2:27][c:28]2[cH:29][c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]2)[C:42]([CH3:43])=[O:44])[CH2:23][CH2:24][CH2:25]1.[NH2:1][c:2]1[c:3]([Cl:12])[cH:4][cH:5][cH:6][c:7]1[C:8]([O:9][CH3:10])=[O:11]>>[Cl:12][c:48]1[c:20]2[c:21]([cH:45][cH:46][cH:47]1)[CH:22]([N:26]([CH2:27][c:28]1[cH:29][c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]1)[C:42]([CH3:43])=[O:44])[CH2:23][CH2:24][CH2:25][N:19]2[C:17]([O:16][CH:13]([CH3:14])[CH3:15])=[O:18]Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-61657b3f4cac4c88a9800f238cef775c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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