(4-(Aminomethyl)phenyl)(phenyl)methanone → 6-(4-benzoyl-benzylamino)-7-chloro-3-(2,2,2-trifluoroacetyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepine
Reaction equation
[Cl:1][c:2]1[c:3]([O:19][S:20]([C:21]([F:22])([F:23])[F:24])(=[O:25])=[O:26])[c:4]2[c:5]([cH:17][cH:18]1)[CH2:6][CH2:7][N:8]([C:11]([C:12]([F:13])([F:14])[F:15])=[O:16])[CH2:9][CH2:10]2.[NH2:27][CH2:28][c:29]1[cH:30][cH:31][c:32]([C:33](=[O:34])[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:41][cH:42]1>>[Cl:1][c:2]1[c:3]([NH:27][CH2:28][c:29]2[cH:30][cH:31][c:32]([C:33](=[O:34])[c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[cH:41][cH:42]2)[c:4]2[c:5]([cH:17][cH:18]1)[CH2:6][CH2:7][N:8]([C:11]([C:12]([F:13])([F:14])[F:15])=[O:16])[CH2:9][CH2:10]2Participants
3
Sources & evidence
- ORD record
- ord-4c37f5c296a84d748ac0a6ae1f72a3a5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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