Chloride → 2-Bromopropionyl-beta-alanine-benzyl ester
Reaction equation
[Br:2][CH:3]([C:4](=[O:5])[OH:6])[CH3:7].[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[O:26][C:27]([CH2:28][CH2:29][NH2:30])=[O:31].[CH2:40]([Cl:41])[Cl:42].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[Cl-:1].[ClH:39].[OH2:43].[c:8]1([CH3:9])[cH:10][cH:11][c:12]([S:13]([OH:14])(=[O:15])=[O:16])[cH:17][cH:18]1>>[Br:2][CH:3]([C:4](=[O:5])[NH:30][CH2:29][CH2:28][C:27]([O:26][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)=[O:31])[CH3:7]Participants
9
Sources & evidence
- ORD record
- ord-1aecfff9c9d340bd825f75a457abfc29
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…