Ethanol → N-{5-[4-(5-Methylpyrazol-3-ylamino)pyrimidin-2-ylamino]benzothiazol-2-yl}-benzamide
반응식
[CH3:34][CH2:35][OH:36].[Cl:20][c:21]1[n:22][cH:23][cH:24][c:25]([NH:27][c:28]2[n:29][nH:30][c:31]([CH3:33])[cH:32]2)[n:26]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7][c:8]([NH:10][C:11]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)=[O:18])[s:9]2)[cH:19]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7][c:8]([NH:10][C:11]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)=[O:18])[s:9]2)[cH:19]1)[c:21]1[n:22][cH:23][cH:24][c:25]([NH:27][c:28]2[n:29][nH:30][c:31]([CH3:33])[cH:32]2)[n:26]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-08f9c389aeb1402686d5b74e3e4b5744
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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