Methanol → HCID 178484354, compound
Reaction equation
[C:22](=[O:23])([n:24]1[cH:25][cH:26][n:27][cH:28]1)[n:29]1[cH:30][cH:31][n:32][cH:33]1.[C:50]([O:51][CH2:52][CH3:53])(=[O:54])[CH3:55].[CH3:48][OH:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][N:11]([CH2:12][CH2:13][NH2:14])[CH3:15])[c:16]2[n:17][cH:18][cH:19][cH:20][cH:21]2)[cH:6][cH:7]1.[NH:34]([C:35](=[NH:36])[NH2:37])[c:38]1[s:39][cH:40][c:41]([CH2:43][S:44][CH2:45][CH2:46][NH2:47])[n:42]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][N:11]([CH2:12][CH2:13][NH:14][C:22](=[O:23])[NH:47][CH2:46][CH2:45][S:44][CH2:43][c:41]2[cH:40][s:39][c:38]([NH:34][C:35](=[NH:36])[NH2:37])[n:42]2)[CH3:15])[c:16]2[n:17][cH:18][cH:19][cH:20][cH:21]2)[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-131acc03330a4846be95feecb72b8d16
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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