Ethanol → HCID 178521377, compound
Reaction equation
[CH3:31][CH2:32][OH:33].[Cl:15][c:16]1[cH:17][cH:18][c:19]2[c:20]([s:21][c:22]([C:24]3=[CH:29][CH2:28][NH:27][CH2:26][CH2:25]3)[cH:23]2)[cH:30]1.[O:1]1[CH:2]([CH2:4][O:5][c:6]2[c:7]3[cH:8][cH:9][nH:10][c:11]3[cH:12][cH:13][cH:14]2)[CH2:3]1>>[OH:1][CH:2]([CH2:3][N:27]1[CH2:26][CH2:25][C:24]([c:22]2[s:21][c:20]3[c:19]([cH:18][cH:17][c:16]([Cl:15])[cH:30]3)[cH:23]2)=[CH:29][CH2:28]1)[CH2:4][O:5][c:6]1[c:7]2[cH:8][cH:9][nH:10][c:11]2[cH:12][cH:13][cH:14]1Participants
4
Sources & evidence
- ORD record
- ord-47547c7e235c48ea9cc91d1d7af67312
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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