6-Chloro-1-benzothiophene-2-carboxylic acid → 3-(3-Cyanophenyl)-2-[1-(6-chlorobenzo[b]thiophene-2-carbonyl)-pyrrolidin-2-yl]-propionic acid methyl ester
반응식
[CH3:14][O:15][C:16]([CH:17]([CH2:18][c:19]1[cH:20][c:21]([C:25]#[N:26])[cH:22][cH:23][cH:24]1)[CH:27]1[NH:28][CH2:29][CH2:30][CH2:31]1)=[O:32].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([s:7][c:8]([C:10](=[O:11])[OH:12])[cH:9]2)[cH:13]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([s:7][c:8]([C:10](=[O:12])[N:28]3[CH:27]([CH:17]([C:16]([O:15][CH3:14])=[O:32])[CH2:18][c:19]4[cH:20][c:21]([C:25]#[N:26])[cH:22][cH:23][cH:24]4)[CH2:31][CH2:30][CH2:29]3)[cH:9]2)[cH:13]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-c708d5135f124ee68a5d3416831c6ed8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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