Bromide ion → tert-butyl (2RS,5SR)-1-{2-[3-(4-chlorophenyl)ureido]acetyl}-5-phenylprolinate
Reaction equation
[Br-:37].[CH3:33][S:34]([CH3:35])=[O:36].[Cl:23][c:24]1[cH:25][cH:26][c:27]([N:30]=[C:31]=[O:32])[cH:28][cH:29]1.[K+:38].[NH2:1][CH2:2][C:3](=[O:4])[N:5]1[CH:6]([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:14][CH2:15][CH:16]1[c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1>>[NH:1]([CH2:2][C:3](=[O:4])[N:5]1[CH:6]([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:14][CH2:15][CH:16]1[c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[C:31]([NH:30][c:27]1[cH:26][cH:25][c:24]([Cl:23])[cH:29][cH:28]1)=[O:32]Participants
7
Sources & evidence
- ORD record
- ord-5b7a6b8610c24092b70de9cb7c30f0df
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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