Dichloromethane → [2-(5-Chloro-2-{2-[4-(4-fluoro-benzyl)-2-methyl-piperazin-1-yl]-2-oxo-ethoxy}-phenylcarbamoyl)-ethyl]-carbamic acid tert-butyl ester
Reaction equation
[C:35]([CH3:36])([CH3:37])([CH3:38])[O:39][C:40](=[O:41])[NH:42][CH2:43][CH2:44][C:45](=[O:46])[OH:47].[CH2:72]([Cl:73])[Cl:74].[CH3:28][N:29]1[CH2:30][CH2:31][O:32][CH2:33][CH2:34]1.[NH2:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[N:8]2[CH:9]([CH3:22])[CH2:10][N:11]([CH2:14][c:15]3[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]3)[CH2:12][CH2:13]2)[cH:23][cH:24][c:25]([Cl:27])[cH:26]1.[P-:48]([F:49])([F:50])([F:51])([F:52])([F:53])[F:54].[n:55]1([O:56][C:57]([N:58]([CH3:59])[CH3:60])=[N+:61]([CH3:62])[CH3:63])[c:64]2[cH:65][cH:66][cH:67][cH:68][c:69]2[n:70][n:71]1>>[NH:1]([c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[N:8]2[CH:9]([CH3:22])[CH2:10][N:11]([CH2:14][c:15]3[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]3)[CH2:12][CH2:13]2)[cH:23][cH:24][c:25]([Cl:27])[cH:26]1)[C:45]([CH2:44][CH2:43][NH:42][C:40]([O:39][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:41])=[O:46]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0d74a130218044d99604a9e164e7d9b5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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