Chloride → HCID 10119707, compound
Reaction equation
[CH:41]([CH3:42])([CH3:43])[NH:44][CH3:45].[Cl-:40].[Cl:46][CH2:47][Cl:48].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH:1][CH2:2][c:3]1[cH:4][n:5][n:6][n:7]1-[c:8]1[cH:9][c:10]([C:14]2=[N:15][c:16]3[c:17]([cH:22][c:23]([C:32]([F:33])([F:34])[F:35])[c:24]([N:26]([CH3:27])[CH2:28][CH:29]([CH3:30])[CH3:31])[cH:25]3)[NH:18][C:19](=[O:21])[CH2:20]2)[cH:11][cH:12][cH:13]1.[S:36]([Cl:37])([Cl:38])=[O:39]>>[CH2:2]([c:3]1[cH:4][n:5][n:6][n:7]1-[c:8]1[cH:9][c:10]([C:14]2=[N:15][c:16]3[c:17]([cH:22][c:23]([C:32]([F:33])([F:34])[F:35])[c:24]([N:26]([CH3:27])[CH2:28][CH:29]([CH3:30])[CH3:31])[cH:25]3)[NH:18][C:19](=[O:21])[CH2:20]2)[cH:11][cH:12][cH:13]1)[N:44]([CH:41]([CH3:42])[CH3:43])[CH3:45]Participants
7
Sources & evidence
- ORD record
- ord-da87115844d847cc9f469c4bb153defc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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