1,2-Dichloroethane → 1,1-Dimethylethyl 4-({5'-[({[3-(chloromethyl)phenyl]carbonyl}amino)methyl]-2'-fluoro-3-biphenylyl}methyl)-1-piperazinecarboxylate
Reaction equation
[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[Cl:30][CH2:31][c:32]1[cH:33][c:34]([C:35](=[O:36])[OH:37])[cH:38][cH:39][cH:40]1.[Cl:68][CH2:69][Cl:70].[NH2:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([F:29])[c:7](-[c:9]2[cH:10][c:11]([CH2:15][N:16]3[CH2:17][CH2:18][N:19]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH2:20][CH2:21]3)[cH:12][cH:13][cH:14]2)[cH:8]1.[O:62]1[CH2:63][CH2:64][O:65][CH2:66][CH2:67]1.[OH:45][n:46]1[c:47]2[c:48]([cH:49][cH:50][cH:51][cH:52]2)[n:53][n:54]1>>[NH:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([F:29])[c:7](-[c:9]2[cH:10][c:11]([CH2:15][N:16]3[CH2:17][CH2:18][N:19]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH2:20][CH2:21]3)[cH:12][cH:13][cH:14]2)[cH:8]1)[C:35]([c:34]1[cH:33][c:32]([CH2:31][Cl:30])[cH:40][cH:39][cH:38]1)=[O:36]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-c19517a7005440c7945f4f21bae3a553
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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