Water → HCID 21958988, compound
Reaction equation
[CH2:42]([Cl:43])[Cl:44].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:14])[OH:15])[CH2:16][CH:17]2[CH2:18][S:19][CH2:20][CH2:21][CH2:22]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11].[Cl:23][C:24]([C:25]([Cl:26])=[O:27])=[O:28].[NH2:29][c:30]1[n:31][cH:32][cH:33][n:34][cH:35]1.[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:50].[cH:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:15])[NH:29][c:30]2[n:31][cH:32][cH:33][n:34][cH:35]2)[CH2:16][CH:17]2[CH2:18][S:19][CH2:20][CH2:21][CH2:22]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11]Participants
9
Sources & evidence
- ORD record
- ord-38bd1db9e55b434ca75e0d1146396007
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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