Ethanol → HCID 178487926, compound
Reaction equation
[BH4-:44].[CH3:49][CH2:50][OH:51].[Cl:46][CH2:47][Cl:48].[NH2:1][CH2:2][CH:3]1[CH2:4][N:5]([CH2:8][CH:9]([OH:10])[c:11]2[c:12]([F:23])[cH:13][n:14][c:15]3[cH:16][cH:17][c:18]([O:21][CH3:22])[n:19][c:20]23)[CH2:6][CH2:7]1.[Na+:37].[Na+:38].[Na+:45].[O-:39][S:40]([O-:41])(=[O:42])=[O:43].[O:24]=[C:25]1[NH:26][c:27]2[c:28]([cH:31][cH:32][c:33]([CH:35]=[O:36])[n:34]2)[S:29][CH2:30]1>>[NH:1]([CH2:2][CH:3]1[CH2:4][N:5]([CH2:8][CH:9]([OH:10])[c:11]2[c:12]([F:23])[cH:13][n:14][c:15]3[cH:16][cH:17][c:18]([O:21][CH3:22])[n:19][c:20]23)[CH2:6][CH2:7]1)[CH2:35][c:33]1[cH:32][cH:31][c:28]2[c:27]([n:34]1)[NH:26][C:25](=[O:24])[CH2:30][S:29]2Participants
8
Sources & evidence
- ORD record
- ord-1d0ec625f8ad4b44a2a5d67d2c74c6e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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