Ethyl 4-(piperazin-1-yl)benzoate → 4-{4-[5-(3-Fluoro-5-iodo-phenylcarbamoyl)-pyridin-2-yl]-piperazin-1-yl}-benzoic acid ethyl ester
Reaction equation
[CH2:19]([CH3:20])[O:21][C:22]([c:23]1[cH:24][cH:25][c:26]([N:29]2[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]2)[cH:27][cH:28]1)=[O:35].[CH2:36]([O:37][C:38](=[O:39])[c:40]1[cH:41][cH:42][c:43]([N:44]2[CH2:45][CH2:46][N:47]([c:48]3[cH:49][cH:50][c:51]([C:52](=[O:53])[NH:54][c:55]4[cH:56][cH:57][c:58]([CH3:59])[c:60]([I:61])[cH:62]4)[cH:63][n:64]3)[CH2:65][CH2:66]2)[cH:67][cH:68]1)[CH3:69].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[NH:8][c:9]2[cH:10][c:11]([F:16])[cH:12][c:13]([I:15])[cH:14]2)[cH:17][cH:18]1>>[c:2]1([N:32]2[CH2:31][CH2:30][N:29]([c:26]3[cH:25][cH:24][c:23]([C:22]([O:21][CH2:19][CH3:20])=[O:35])[cH:28][cH:27]3)[CH2:34][CH2:33]2)[n:3][cH:4][c:5]([C:6](=[O:7])[NH:8][c:9]2[cH:10][c:11]([F:16])[cH:12][c:13]([I:15])[cH:14]2)[cH:17][cH:18]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-4ce30b706ba04271a9512ebb06d904c3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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