Acetic Acid → 2-Oxo-3-tert-butoxycarbonylamino-5-cyclohexyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine
Reaction equation
[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:36][C:37](=[O:38])[OH:39].[H:28][H:29].[O:1]=[C:2]1[CH:3]([NH:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:4][NH:5][c:6]2[c:7]([cH:9][cH:10][cH:11][cH:12]2)[NH:8]1.[O:21]=[C:22]1[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]1.[Pt:40]=[O:41]>>[O:1]=[C:2]1[CH:3]([NH:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:4][N:5]([CH:22]2[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]2)[c:6]2[c:7]([cH:9][cH:10][cH:11][cH:12]2)[NH:8]1Participants
7
Sources & evidence
- ORD record
- ord-edc034c4ff2c44758e082fe961e03f8d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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