Methanol → HCID 59704210, compound
Reaction equation
[CH3:53][OH:54].[Cl:48][CH2:49][Cl:50].[Na+:52].[OH-:51].[cH:1]1[c:2]2[c:14]([cH:15][cH:46][cH:47]1)-[c:9]1[c:8]([cH:13][cH:12][cH:11][cH:10]1)[CH:3]2[O:4][C:5](=[O:6])[N:16]([CH3:7])[CH2:17][C:18]([NH:19][c:20]1[cH:21][cH:22][c:23]2[c:28]([c:29]1[NH2:30])[O:27][C:26]([NH2:31])=[C:25]([C:32]#[N:33])[CH:24]2[c:34]1[cH:35][c:36]([Br:44])[c:37]([O:42][CH3:43])[c:38]([O:40][CH3:41])[cH:39]1)=[O:45]>>[NH2:16][CH2:17][C:18]([NH:19][c:20]1[cH:21][cH:22][c:23]2[c:28]([c:29]1[NH2:30])[O:27][C:26]([NH2:31])=[C:25]([C:32]#[N:33])[CH:24]2[c:34]1[cH:35][c:36]([Br:44])[c:37]([O:42][CH3:43])[c:38]([O:40][CH3:41])[cH:39]1)=[O:45]Participants
6
Sources & evidence
- ORD record
- ord-a5a01d05a4d5474cb2c23980f3889d27
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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