Acetic Acid → N-(5-tert-butyl-4-mercapto-2-methylphenyl)carbamic acid tert-butyl ester
Reaction equation
[BH4-:26].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([CH3:21])[cH:10][c:11]([S:18][C:19]#[N:20])[c:12]([C:14]([CH3:15])([CH3:16])[CH3:17])[cH:13]1)=[O:22].[CH3:30][C:31](=[O:32])[OH:33].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:42][OH:43].[H:28][H:29].[Na+:25].[Na+:27].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH2:23].[OH2:41].[SH-:24]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([CH3:21])[cH:10][c:11]([SH:18])[c:12]([C:14]([CH3:15])([CH3:16])[CH3:17])[cH:13]1)=[O:22]Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-25cc442522d9427cb15c2d35b0239186
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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