Chloride → 2-[5-[4-(t-Butoxycarbonylmethyl)hexahydro-1,4-diazepin-1-yl]pyrazin-2-ylcarbonylamino]-5-fluoro-N-(5-chloropyridin-2-yl)benzamide
Reaction equation
[Br:43][CH2:44][C:45](=[O:46])[O:47][C:48]([CH3:49])([CH3:50])[CH3:51].[CH2:52]([Cl:53])[Cl:54].[CH3:56][N+:57]([CH2:58][CH2:59][CH2:60][CH3:61])([CH2:62][CH2:63][CH2:64][CH3:65])[CH2:66][CH2:67][CH2:68][CH3:69].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[Cl-:55].[F:1][c:2]1[cH:3][cH:4][c:5]([NH:18][C:19](=[O:20])[c:21]2[n:22][cH:23][c:24]([N:27]3[CH2:28][CH2:29][NH:30][CH2:31][CH2:32][CH2:33]3)[n:25][cH:26]2)[c:6]([C:7](=[O:8])[NH:9][c:10]2[n:11][cH:12][c:13]([Cl:16])[cH:14][cH:15]2)[cH:17]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([NH:18][C:19](=[O:20])[c:21]2[n:22][cH:23][c:24]([N:27]3[CH2:28][CH2:29][N:30]([CH2:44][C:45](=[O:46])[O:47][C:48]([CH3:49])([CH3:50])[CH3:51])[CH2:31][CH2:32][CH2:33]3)[n:25][cH:26]2)[c:6]([C:7](=[O:8])[NH:9][c:10]2[n:11][cH:12][c:13]([Cl:16])[cH:14][cH:15]2)[cH:17]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-76b86573ef8d475aa50fe1838c92b679
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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