Toluene → 5-Methylisoxazole-3-carbothioamide
반응식
[CH3:10][O:11][c:12]1[cH:13][cH:14][c:15]([P:16]2(=[S:19])[S:17][P:18]([c:20]3[cH:21][cH:22][c:23]([O:24][CH3:25])[cH:26][cH:27]3)(=[S:28])[S:29]2)[cH:30][cH:31]1.[CH3:1][c:2]1[cH:3][c:4]([C:7](=[O:8])[NH2:9])[n:5][o:6]1.[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[CH3:1][c:2]1[cH:3][c:4]([C:7]([NH2:9])=[S:19])[n:5][o:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-3a712ce43ad14381a16b79f392362959
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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