Dichloromethane → 2-[4-(4-Bromophenyl)piperazine-1-sulfonylmethyl]-3-methylbutyric acid
Reaction equation
[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([CH:14]([CH:15]([CH3:16])[CH3:17])[CH2:18][S:19](=[O:20])(=[O:21])[N:22]1[CH2:23][CH2:24][N:25]([c:28]2[cH:29][cH:30][c:31]([Br:34])[cH:32][cH:33]2)[CH2:26][CH2:27]1)=[O:35].[Cl:36][CH2:37][Cl:38].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[O:12]=[C:13]([CH:14]([CH:15]([CH3:16])[CH3:17])[CH2:18][S:19](=[O:20])(=[O:21])[N:22]1[CH2:23][CH2:24][N:25]([c:28]2[cH:29][cH:30][c:31]([Br:34])[cH:32][cH:33]2)[CH2:26][CH2:27]1)[OH:35]Participants
4
Sources & evidence
- ORD record
- ord-5385c621b0f348f9875a6b5dcfea1201
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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