Methanol → HCID 67202647, compound
Reaction equation
[CH3:47][OH:48].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[F:1][c:2]1[cH:3][c:4]([S:9](=[O:10])(=[O:11])[N:12]2[CH2:13][c:14]3[c:15]([n:18]([C:28]([c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)[n:19][c:20]3[NH:21][C:22](=[O:23])[C:24]([F:25])([F:26])[F:27])[CH2:16][CH2:17]2)[cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[cH:3][c:4]([S:9](=[O:10])(=[O:11])[N:12]2[CH2:13][c:14]3[c:15]([n:18]([C:28]([c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)[n:19][c:20]3[NH2:21])[CH2:16][CH2:17]2)[cH:5][c:6]([F:8])[cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-0cd6df2941a440118becee057c2fcb6c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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