Hydrochloric Acid → 2-anilino-5,6,8,9,10,11-hexahydro-7H-[1,4]diazepino[1',2':1,5]pyrazolo[4,3-h]quinazolin-7-one
Reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:37][OH:38].[ClH:1].[Cs+:35].[Cs+:36].[NH2:2][CH2:3][CH2:4][CH2:5][n:6]1[n:7][c:8]2[c:9]([c:25]1[C:26]([O:28][CH2:27][CH3:29])=[O:30])[CH2:10][CH2:11][c:12]1[cH:13][n:14][c:15]([NH:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[n:16][c:17]1-2>>[NH:2]1[CH2:3][CH2:4][CH2:5][n:6]2[n:7][c:8]3[c:9]([c:25]2[C:26]1=[O:28])[CH2:10][CH2:11][c:12]1[cH:13][n:14][c:15]([NH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[n:16][c:17]1-3Participants
6
Sources & evidence
- ORD record
- ord-a1f25cb4b1c744c9b5d39b92df65ad56
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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