Hydrochloric Acid → 2,3,3a,4,9,10a-hexahydrobenzo[b]cyclopenta[e][1,4]diazepin-10(1H)-one
Reaction equation
[Br:16][c:17]1[cH:18][cH:19][cH:20][c:21]([OH:22])[c:23]1[CH3:24].[C:25]([BH3-:26])#[N:27].[CH2:1]1[CH2:2][CH2:3][C:4]2=[N:5][c:6]3[c:7]([cH:12][cH:13][cH:14][cH:15]3)[NH:8][C:9](=[O:11])[CH:10]12.[CH3:29][OH:30].[CH3:37][OH:38].[ClH:31].[Na+:28].[Na+:32].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH2:44].[OH:33][C:34](=[O:35])[O-:36]>>[CH2:1]1[CH2:2][CH2:3][CH:4]2[NH:5][c:6]3[c:7]([cH:12][cH:13][cH:14][cH:15]3)[NH:8][C:9](=[O:11])[CH:10]12Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-975c44273fbf4bc8ad8df0adb6003dc7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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