Acetic Acid → 6-tert-Butyl-7-mercapto-1,4-dihydro-quinoxaline-2,3-dione
Reaction equation
[BH4-:22].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[nH:8][c:9](=[O:19])[c:10](=[O:18])[nH:11][c:12]2[cH:13][c:14]1[S:15][C:16]#[N:17].[C:26]([OH:27])(=[O:28])[CH3:29].[CH3:24][OH:25].[Na+:23].[Na:21].[SH2:20]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]2[nH:8][c:9](=[O:19])[c:10](=[O:18])[nH:11][c:12]2[cH:13][c:14]1[SH:15]Participants
8
Sources & evidence
- ORD record
- ord-0dbbd635a2784cfdb6df89b5048e599f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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