Toluene → 2-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-thiazole-5-carboxylic acid isoprop-ylamide
반응식
[CH2:9]([O:11][C:12](=[O:10])[c:14]1[cH:15][n:16][c:17]([O:19][CH2:20][c:21]2[c:22](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[n:23][o:24][c:25]2[CH3:26])[s:18]1)[CH3:13].[CH3:1][CH:2]([CH3:3])[NH2:4].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:5][Al:6]([CH3:7])[CH3:8].[O:33]1[CH2:34][CH2:35][O:36][CH2:37][CH2:38]1>>[CH3:1][CH:2]([CH3:3])[NH:4][C:12](=[O:11])[c:14]1[cH:15][n:16][c:17]([O:19][CH2:20][c:21]2[c:22](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[n:23][o:24][c:25]2[CH3:26])[s:18]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-147262c7b5be4e08bb6e245cc6c37720
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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