Chloride → Tert-butyl 5-chloro-1-(4-methoxycarbonylphenyl)pyrazole-4-carboxylate
반응식
[C:1]([O:2][N:3]=[O:4])([CH3:5])([CH3:6])[CH3:7].[CH3:9][C:10]#[N:11].[Cl-:8].[NH2:12][c:13]1[c:14]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:15][n:16][n:17]1-[c:18]1[cH:19][cH:20][c:21]([C:24](=[O:25])[O:26][CH3:27])[cH:22][cH:23]1.[OH2:35]>>[Cl:8][c:13]1[c:14]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[cH:15][n:16][n:17]1-[c:18]1[cH:19][cH:20][c:21]([C:24](=[O:25])[O:26][CH3:27])[cH:22][cH:23]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-c73f92e819b744a98d468de569cb6650
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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