Methanol → HCID 178509417, compound
Reaction equation
[CH3:29][OH:30].[Cl:1][c:2]1[c:3](-[c:9]2[c:10]([C:25]#[N:26])[c:11]([C:19]3=[CH:24][CH2:23][O:22][CH2:21][CH2:20]3)[s:12][c:13]2-[c:14]2[n:15][n:16][cH:17][nH:18]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[H:27][H:28]>>[Cl:1][c:2]1[c:3](-[c:9]2[c:10]([C:25]#[N:26])[c:11]([CH:19]3[CH2:20][CH2:21][O:22][CH2:23][CH2:24]3)[s:12][c:13]2-[c:14]2[n:15][n:16][cH:17][nH:18]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-4f5bf43e049d47b6989dda8187b86c7f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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