m-Chloroperbenzoic acid → 4-[2-[Ethyl[3-(propylsulfinyl)propyl]amino]-1-hydroxyethyl]-benzonitrile
Reaction equation
[CH2:1]([CH3:2])[N:3]([CH2:4][CH:5]([OH:6])[c:7]1[cH:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]1)[CH2:15][CH2:16][CH2:17][S:18][CH2:19][CH2:20][CH3:21].[Cl:22][c:23]1[cH:24][cH:25][cH:26][c:27]([C:28]([O:29][OH:31])=[O:30])[cH:32]1>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH:5]([OH:6])[c:7]1[cH:8][cH:9][c:10]([C:11]#[N:12])[cH:13][cH:14]1)[CH2:15][CH2:16][CH2:17][S:18]([CH2:19][CH2:20][CH3:21])=[O:30]Participants
3
Sources & evidence
- ORD record
- ord-828ca69205444f23ab573df8a5ed5603
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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