Ethanol → HCID 20521441, compound
Reaction equation
[CH3:1][O-:2].[CH3:26][CH2:27][OH:28].[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[IH:4].[NH:5]=[c:6]1[n:7]([CH3:16])[c:8]2[c:9]([n:10]1[CH3:11])[cH:12][cH:13][cH:14][cH:15]2.[Na+:3].[c:17]1([N:23]=[C:24]=[S:25])[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[N:5](=[c:6]1[n:7]([CH3:16])[c:8]2[c:9]([n:10]1[CH3:11])[cH:12][cH:13][cH:14][cH:15]2)[C:24]([NH:23][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)=[S:25]Participants
8
Sources & evidence
- ORD record
- ord-792e826927664462bdc86ecd4fa1f56f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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