Chloride → HCID 22317998, compound
Reaction equation
[CH2:42]([CH:43]([CH3:44])[CH3:45])[NH:46][CH3:47].[Cl-:41].[Cl:48][CH2:49][Cl:50].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH:1][CH2:2][c:3]1[n:4][cH:5][cH:6][c:7](-[c:9]2[cH:10][c:11]([C:15]3=[N:16][c:17]4[c:18]([cH:23][c:24]([C:33]([F:34])([F:35])[F:36])[c:25]([N:27]([CH3:28])[CH2:29][CH:30]([CH3:31])[CH3:32])[cH:26]4)[NH:19][C:20](=[O:22])[CH2:21]3)[cH:12][cH:13][cH:14]2)[cH:8]1.[S:37]([Cl:38])([Cl:39])=[O:40]>>[CH2:2]([c:3]1[n:4][cH:5][cH:6][c:7](-[c:9]2[cH:10][c:11]([C:15]3=[N:16][c:17]4[c:18]([cH:23][c:24]([C:33]([F:34])([F:35])[F:36])[c:25]([N:27]([CH3:28])[CH2:29][CH:30]([CH3:31])[CH3:32])[cH:26]4)[NH:19][C:20](=[O:22])[CH2:21]3)[cH:12][cH:13][cH:14]2)[cH:8]1)[N:46]([CH2:42][CH:43]([CH3:44])[CH3:45])[CH3:47]Participants
7
Sources & evidence
- ORD record
- ord-83155e6e1e534b2d831bfcb99b9684f2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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