Water → HCID 10000140, compound
Reaction equation
[CH3:59][N:60]([CH3:61])[CH:62]=[O:63].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Cl:1][c:2]1[cH:3][c:4]([CH:9]([C:10](=[O:11])[OH:12])[CH2:13][CH:14]2[O:15][CH2:16][CH2:17][CH2:18][CH2:19]2)[cH:5][cH:6][c:7]1[Cl:8].[NH2:53][c:54]1[s:55][cH:56][cH:57][n:58]1.[OH2:64].[P-:20]([F:21])([F:22])([F:23])([F:24])([F:25])[F:26].[n:27]1([O:28][C:29]([N:30]([CH3:31])[CH3:32])=[N+:33]([CH3:34])[CH3:35])[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[n:42][n:43]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]([C:10](=[O:12])[NH:53][c:54]2[s:55][cH:56][cH:57][n:58]2)[CH2:13][CH:14]2[O:15][CH2:16][CH2:17][CH2:18][CH2:19]2)[cH:5][cH:6][c:7]1[Cl:8]Participants
8
Sources & evidence
- ORD record
- ord-02d26f87ec5545e7b3141edc38396299
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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