Methanol → HCID 53785557, compound
Reaction equation
[CH3:27][OH:28].[CH:29]([Cl:30])([Cl:31])[Cl:32].[NH2:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[c:7]2[n:8][c:9]([CH2:11][CH2:12][C:13](=[S:14])[OH:15])[n:10]1.[S:23]([Cl:24])([Cl:25])=[O:26]>>[NH2:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[c:7]2[n:8][c:9]([CH2:11][CH2:12][C:13](=[S:14])[O:15][CH3:27])[n:10]1Participants
5
Sources & evidence
- ORD record
- ord-d54b6f389e5540469d21ef802486b4a0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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