Water → HCID 58659451, compound
Reaction equation
[CH2:20]([CH3:21])[N:22]1[CH2:23][CH2:24][N:25]([CH2:28][c:29]2[cH:30][c:31]([NH2:39])[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]2)[CH2:26][CH2:27]1.[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[Cl:16][C:17]([Cl:18])=[O:19].[Cl:1][c:2]1[cH:3][c:4]([O:8][c:9]2[cH:10][cH:11][c:12]([NH2:13])[cH:14][cH:15]2)[n:5][cH:6][n:7]1.[Cl:40][CH2:41][Cl:42].[OH2:55]>>[Cl:1][c:2]1[cH:3][c:4]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:13][C:17](=[O:19])[NH:39][c:31]3[cH:30][c:29]([CH2:28][N:25]4[CH2:24][CH2:23][N:22]([CH2:20][CH3:21])[CH2:27][CH2:26]4)[cH:34][c:33]([C:35]([F:36])([F:37])[F:38])[cH:32]3)[cH:14][cH:15]2)[n:5][cH:6][n:7]1Participants
9
Sources & evidence
- ORD record
- ord-73a832c15bfb43fab17738868492ea5b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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