Methanol → HCID 54041039, compound
Reaction equation
[CH2:56]([Cl:57])[Cl:58].[CH2:59]([Cl:60])[Cl:61].[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:49][S:50]([Cl:51])(=[O:52])=[O:53].[CH3:54][OH:55].[Cl:1][c:2]1[cH:3][c:4]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:37][CH2:38][CH:39]4[CH2:40][CH2:41]4)[c:17]([NH:20][C:21]([CH:22]=[CH:23][CH2:24][N:25]4[CH:26]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:27][NH:28][CH2:29][CH2:30]4)=[O:36])[cH:18][c:19]23)[cH:5][cH:6][c:7]1[F:8]>>[Cl:1][c:2]1[cH:3][c:4]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:37][CH2:38][CH:39]4[CH2:40][CH2:41]4)[c:17]([NH:20][C:21]([CH:22]=[CH:23][CH2:24][N:25]4[CH:26]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:27][N:28]([S:50]([CH3:49])(=[O:52])=[O:53])[CH2:29][CH2:30]4)=[O:36])[cH:18][c:19]23)[cH:5][cH:6][c:7]1[F:8]Participants
6
Sources & evidence
- ORD record
- ord-4cf8e83124e14a39be57ccb472adf6bb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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