Sodium ion → HCID 53794555, compound
Reaction equation
[CH2:1]([c:2]1[n:3](-[c:4]2[c:5]([F:6])[cH:7][cH:8][cH:9][c:10]2[Cl:11])[c:12]([CH:13]=[O:14])[c:15]([CH3:16])[n:17]1)[CH2:18][CH2:19][CH3:20].[CH2:35]([CH2:36][CH2:37][CH3:38])[c:39]1[n:40]([CH2:56][c:57]2[c:58]([Cl:64])[cH:59][cH:60][cH:61][c:62]2[F:63])[c:41]([CH:44]=[C:45]([C:46](=[O:47])[O:48][CH3:49])[CH2:50][c:51]2[s:52][cH:53][cH:54][cH:55]2)[cH:42][n:43]1.[CH3:23][O:24][CH2:25][CH2:26][O:27][CH3:28].[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[H-:21].[Na+:22]>>[CH2:35]([CH2:36][CH2:37][CH3:38])[c:39]1[n:40]([CH2:56][c:57]2[c:58]([Cl:64])[cH:59][cH:60][cH:61][c:62]2[F:63])[c:41]([CH:44]=[C:45]([C:46](=[O:47])[OH:48])[CH2:50][c:51]2[s:52][cH:53][cH:54][cH:55]2)[cH:42][n:43]1Participants
8
Sources & evidence
- ORD record
- ord-2ff55717e0934bf7bfcb5c3da737f49a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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