Ethanol → HCID 178421352, compound
Reaction equation
[CH3:14][S:15]([O:16][CH:19]1[C:20]2([CH3:21])[CH:22]([CH2:23][CH2:24]1)[CH:25]1[CH2:26][CH2:27][C:28]3=[CH:29][C:30](=[O:39])[CH:31]=[CH:32][C:33]3([CH3:34])[CH:35]1[C:36](=[O:38])[CH2:37]2)(=[O:17])=[O:18].[CH3:2][CH2:3][OH:4].[CH:40]([Cl:41])([Cl:42])[Cl:43].[Cl:5][c:6]1[cH:7][cH:8][c:9]([CH2:10][SH:11])[cH:12][cH:13]1.[Na:1]>>[Cl:5][c:6]1[cH:7][cH:8][c:9]([CH2:10][S:11][CH:19]2[C:20]3([CH3:21])[CH:22]([CH2:23][CH2:24]2)[CH:25]2[CH2:26][CH2:27][C:28]4=[CH:29][C:30](=[O:39])[CH:31]=[CH:32][C:33]4([CH3:34])[CH:35]2[C:36](=[O:38])[CH2:37]3)[cH:12][cH:13]1Participants
6
Sources & evidence
- ORD record
- ord-99681148d5d74a789047c17de264a96c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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