Methanol → HCID 87335941, compound
Reaction equation
[CH3:37][N:38]([c:39]1[cH:40][cH:41][cH:42][cH:43][n:44]1)[CH3:45].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:58][OH:59].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:11](=[O:12])[N:13]3[CH:14]([C:19](=[O:20])[NH:21][C:22]4([C:25]#[N:26])[CH2:23][CH2:24]4)[CH2:15][CH:16]([OH:18])[CH2:17]3)[CH2:9][CH2:10]2)[cH:6][cH:7]1.[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH2:60].[c:27]1([S:33](=[O:34])(=[O:35])[Cl:36])[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:11](=[O:12])[N:13]3[CH:14]([C:19](=[O:20])[NH:21][C:22]4([C:25]#[N:26])[CH2:23][CH2:24]4)[CH2:15][CH:16]([O:18][S:33]([c:27]4[cH:28][cH:29][cH:30][cH:31][cH:32]4)(=[O:34])=[O:35])[CH2:17]3)[CH2:9][CH2:10]2)[cH:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-16578395e8fa41daa025566fe0794416
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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