Ethanol → HCID 20230254, compound
Reaction equation
[CH3:24][SH:25].[CH3:27][CH2:28][OH:29].[Cl:1][CH2:2][CH2:3][c:4]1[n:5][o:6][c:7]([CH:9]([c:10]2[cH:11][c:12]([F:22])[c:13](-[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]2)[CH3:23])[n:8]1.[Na:26]>>[CH2:2]([CH2:3][c:4]1[n:5][o:6][c:7]([CH:9]([c:10]2[cH:11][c:12]([F:22])[c:13](-[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]2)[CH3:23])[n:8]1)[S:25][CH3:24]Participants
5
Sources & evidence
- ORD record
- ord-03150af07c084f6184c8da87aba01347
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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