4-Methylpyrazole → N-(4-(2-(3,5-Dimethyl-1H-pyrazol-1-yl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-phenylacetamide
反応式
[CH3:1][c:2]1[cH:3][n:4][n:5](-[c:7]2[cH:8][c:9]3[n:10][cH:11][cH:12][c:13]([O:16][c:17]4[cH:18][cH:19][c:20]([NH:23][C:24](=[S:25])[NH:26][C:27]([CH2:28][c:29]5[cH:30][cH:31][cH:32][cH:33][cH:34]5)=[O:35])[cH:21][cH:22]4)[c:14]3[s:15]2)[cH:6]1.[CH3:36][c:37]1[cH:38][n:39][nH:40][cH:41]1.[CH3:42][c:43]1[n:44][nH:45][c:46]([CH3:48])[cH:47]1>>[c:7]1(-[n:45]2[n:44][c:43]([CH3:42])[cH:47][c:46]2[CH3:48])[cH:8][c:9]2[n:10][cH:11][cH:12][c:13]([O:16][c:17]3[cH:18][cH:19][c:20]([NH:23][C:24](=[S:25])[NH:26][C:27]([CH2:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)=[O:35])[cH:21][cH:22]3)[c:14]2[s:15]1参加物
4
出典と根拠
- ORDレコード
- ord-425ca048043649d68e7f4599d7d0bbb7
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
- DOI