Chloride → HCID 58709822, compound
Reaction equation
[CH3:40][N:41]1[CH2:42][CH2:43][N:44]([C:47](=[O:48])[Cl:49])[CH2:45][CH2:46]1.[CH3:4][n:5]1[n:6][cH:7][c:8]2[cH:9][c:10]([NH:14][c:15]3[c:16]4[c:17]([n:18][cH:19][n:20]3)[nH:21][c:22]([C:24]3=[CH:29][CH2:28][NH:27][CH2:26][CH2:25]3)[cH:23]4)[cH:11][cH:12][c:13]12.[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[Cl-:50].[ClH:1].[ClH:2].[ClH:39].[ClH:3].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:56]>>[CH3:4][n:5]1[n:6][cH:7][c:8]2[cH:9][c:10]([NH:14][c:15]3[c:16]4[c:17]([n:18][cH:19][n:20]3)[nH:21][c:22]([C:24]3=[CH:29][CH2:28][N:27]([C:47]([N:44]5[CH2:43][CH2:42][N:41]([CH3:40])[CH2:46][CH2:45]5)=[O:48])[CH2:26][CH2:25]3)[cH:23]4)[cH:11][cH:12][c:13]12Participants
8
Sources & evidence
- ORD record
- ord-9fb08125f46b431f91149a8dc125ad6b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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