Water → HCID 10414655, compound
Reaction equation
[CH2:49]([Cl:50])[Cl:51].[CH3:16][c:17]1[c:18]2[c:19]([n:20][c:21]([N:23]3[CH2:24][CH2:25][N:26]([c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[CH2:27][CH2:28]3)[n:22]1)[n:35](-[c:40]1[cH:41][cH:42][c:43]([C:44](=[O:45])[Cl:46])[cH:47][cH:48]1)[c:36](=[O:39])[cH:37][cH:38]2.[CH3:9][CH2:10][N:11]([CH2:12][CH3:13])[CH2:14][CH3:15].[NH2:1][CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1.[OH2:52]>>[NH:1]([CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[C:44]([c:43]1[cH:42][cH:41][c:40](-[n:35]2[c:19]3[c:18]([c:17]([CH3:16])[n:22][c:21]([N:23]4[CH2:24][CH2:25][N:26]([c:29]5[cH:30][cH:31][cH:32][cH:33][cH:34]5)[CH2:27][CH2:28]4)[n:20]3)[cH:38][cH:37][c:36]2=[O:39])[cH:48][cH:47]1)=[O:45]Participants
6
Sources & evidence
- ORD record
- ord-0c518f77ced846b18d38950e74bd972f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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