Methanol → HCID 178524331, compound
Reaction equation
[CH3:46][OH:47].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH:13]([NH:17][c:18]3[n:19][cH:20][cH:21][c:22](-[c:24]4[c:25](-[c:32]5[cH:33][c:34]([C:35](=[O:36])[N:37]([O:38][CH3:39])[CH3:40])[cH:41][cH:42][cH:43]5)[n:26][c:27]5[s:28][cH:29][cH:30][n:31]45)[n:23]3)[CH2:14][CH2:15][CH2:16]2)[cH:6][cH:7]1.[Li+:44].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH-:45].[OH2:53]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH:13]([NH:17][c:18]3[n:19][cH:20][cH:21][c:22](-[c:24]4[c:25](-[c:32]5[cH:33][c:34]([C:35]([OH:36])=[O:45])[cH:41][cH:42][cH:43]5)[n:26][c:27]5[s:28][cH:29][cH:30][n:31]45)[n:23]3)[CH2:14][CH2:15][CH2:16]2)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-652dcba1c66a49dea710dba83cacb52a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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