Dichloromethane → {4-[2-Fluoro-4-(4-methyl-pentanoylamino)-phenyl]-piperazin-1-yl}-phenyl-acetic acid methyl ester
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[N:11]1[CH2:12][CH2:13][N:14]([c:17]2[c:18]([F:24])[cH:19][c:20]([NH2:23])[cH:21][cH:22]2)[CH2:15][CH2:16]1)=[O:25].[CH3:26][CH:27]([CH2:28][CH2:29][C:30](=[O:31])[Cl:32])[CH3:33].[Cl:34][CH2:35][Cl:36]>>[CH3:1][O:2][C:3]([CH:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[N:11]1[CH2:12][CH2:13][N:14]([c:17]2[c:18]([F:24])[cH:19][c:20]([NH:23][C:30]([CH2:29][CH2:28][CH:27]([CH3:26])[CH3:33])=[O:31])[cH:21][cH:22]2)[CH2:15][CH2:16]1)=[O:25]Participants
4
Sources & evidence
- ORD record
- ord-65cebeeb8f6942de88afd39326e4fa19
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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