Dimethylformamide → tert-Butyl 4-[(4-iodopyridin-2-yl)carbonyl]-1,4-diazepane-1-carboxylate
Reaction equation
[C:2](=[O:3])([OH:4])[c:5]1[nH+:6][cH:7][cH:8][c:9]([I:11])[cH:10]1.[CH:50]([N:51]([CH2:52][CH3:53])[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[Cl:64][CH2:65][Cl:66].[I-:1].[N:12]1([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:13][CH2:14][NH:15][CH2:16][CH2:17][CH2:18]1.[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[P-:26]([F:27])([F:28])([F:29])([F:30])([F:31])[F:32].[n:33]1([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[N+:39]([CH3:40])[CH3:41])[c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[C:2](=[O:4])([c:5]1[n:6][cH:7][cH:8][c:9]([I:11])[cH:10]1)[N:15]1[CH2:14][CH2:13][N:12]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:18][CH2:17][CH2:16]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-6d5e5cb680904fe4bffb5d919cfe90e5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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