Ethanol → HCID 178460373, compound
Reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:47][CH2:48][OH:49].[O:1]=[S:2]1(=[O:41])[N:3]([CH2:34][c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[CH2:4][CH2:5][O:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([O:13][c:14]1[cH:15][c:16]([C:17](=[O:18])[NH:19][c:20]3[n:21][n:22]([CH3:25])[cH:23][cH:24]3)[cH:26][c:27]([O:29][CH:30]([CH2:31][OH:32])[CH3:33])[cH:28]1)[cH:12]2>>[O:1]=[S:2]1(=[O:41])[NH:3][CH2:4][CH2:5][O:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([O:13][c:14]1[cH:15][c:16]([C:17](=[O:18])[NH:19][c:20]3[n:21][n:22]([CH3:25])[cH:23][cH:24]3)[cH:26][c:27]([O:29][CH:30]([CH2:31][OH:32])[CH3:33])[cH:28]1)[cH:12]2Participants
4
Sources & evidence
- ORD record
- ord-83bd4fdeb48a46b287e0987f44e69044
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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