Ethanol → HCID 22890466, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([N+:35]([O-:36])=[O:37])[c:12]([CH:17]([CH2:18][NH:19][S:20](=[O:21])(=[O:22])[CH2:23][CH2:24][CH3:25])[NH:26][c:27]2[cH:28][cH:29][c:30]([C:33]#[N:34])[cH:31][cH:32]2)[cH:13][c:14]1[O:15][CH3:16].[CH3:38][CH2:39][OH:40]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([NH2:35])[c:12]([CH:17]([CH2:18][NH:19][S:20](=[O:21])(=[O:22])[CH2:23][CH2:24][CH3:25])[NH:26][c:27]2[cH:28][cH:29][c:30]([C:33]#[N:34])[cH:31][cH:32]2)[cH:13][c:14]1[O:15][CH3:16]Participants
3
Sources & evidence
- ORD record
- ord-7c9a658cdb7b4e6089fe2bba691057d9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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