Ethanol → HCID 178488127, compound
Reaction equation
[CH3:27][CH2:28][OH:29].[Cl:1][CH2:2][c:3]1[n:4][cH:5][cH:6][c:7]([N:9]2[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]2)[n:8]1.[Na+:31].[OH-:30].[SH:15][c:16]1[nH:17][c:18]2[c:19]([n:20]1)[cH:21][cH:22][c:23]([O:25][CH3:26])[cH:24]2>>[CH2:2]([c:3]1[n:4][cH:5][cH:6][c:7]([N:9]2[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]2)[n:8]1)[S:15][c:16]1[n:17][c:18]2[c:19]([nH:20]1)[cH:21][cH:22][c:23]([O:25][CH3:26])[cH:24]2Participants
6
Sources & evidence
- ORD record
- ord-7ab88a89301a42298474c8942e77995a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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