8-Amino-5,5-dimethyl-1,3,4,5-tetrahydro-benzo[b]azepin-2-one → HCID 66830054, compound
Reaction equation
[Cl:1][c:2]1[n:3][cH:4][c:5]([Cl:20])[c:6]([NH:8][c:9]2[c:10]([O:11][CH2:12][CH2:13][C:14]#[N:15])[cH:16][cH:17][cH:18][cH:19]2)[n:7]1.[NH2:21][c:22]1[cH:23][cH:24][c:25]2[c:26]([cH:35]1)[NH:27][C:28](=[O:34])[CH2:29][CH2:30][C:31]2([CH3:32])[CH3:33]>>[c:2]1([NH:21][c:22]2[cH:23][cH:24][c:25]3[c:26]([cH:35]2)[NH:27][C:28](=[O:34])[CH2:29][CH2:30][C:31]3([CH3:32])[CH3:33])[n:3][cH:4][c:5]([Cl:20])[c:6]([NH:8][c:9]2[c:10]([O:11][CH2:12][CH2:13][C:14]#[N:15])[cH:16][cH:17][cH:18][cH:19]2)[n:7]1Participants
3
Sources & evidence
- ORD record
- ord-cac141c7e4084b5b801229caccfe0e25
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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