Ethanol → HCID 178484225, compound
Reaction equation
[CH3:1][N:2]([C:3]([O:4][C:5]([CH3:6])([CH3:7])[CH3:8])=[O:9])[CH2:10][CH2:11][N:12]1[c:13]2[c:14]([cH:18][cH:19][c:20]([N+:22]([O-:23])=[O:24])[cH:21]2)[S:15][CH2:16][CH2:17]1.[CH3:37][CH2:38][OH:39].[H:25][H:26].[IH:27].[Pd:40].[s:28]1[c:29]([C:33](=[NH:34])[S:35][CH3:36])[cH:30][cH:31][cH:32]1>>[CH3:1][N:2]([C:3]([O:4][C:5]([CH3:6])([CH3:7])[CH3:8])=[O:9])[CH2:10][CH2:11][N:12]1[c:13]2[c:14]([cH:18][cH:19][c:20]([NH:22][C:33]([c:29]3[s:28][cH:32][cH:31][cH:30]3)=[NH:34])[cH:21]2)[S:15][CH2:16][CH2:17]1Participants
7
Sources & evidence
- ORD record
- ord-19b422a6804a44609e682621e124a68c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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