Dichloromethane → 3-{4-[4-(3,4-Difluoro-phenyl)-6-trifluoromethyl-pyrimidin-2-yl]-pyridin-2-yl}-benzenesulfonamide
反応式
[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][c:11](-[c:15]2[n:16][cH:17][cH:18][c:19](-[c:21]3[n:22][c:23]([C:35]([F:36])([F:37])[F:38])[cH:24][c:25](-[c:27]4[cH:28][c:29]([F:34])[c:30]([F:33])[cH:31][cH:32]4)[n:26]3)[cH:20]2)[cH:12][cH:13][cH:14]1.[Cl:46][CH2:47][Cl:48].[F:39][C:40]([F:41])([F:42])[C:43]([OH:44])=[O:45]>>[NH2:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][c:11](-[c:15]2[n:16][cH:17][cH:18][c:19](-[c:21]3[n:22][c:23]([C:35]([F:36])([F:37])[F:38])[cH:24][c:25](-[c:27]4[cH:28][c:29]([F:34])[c:30]([F:33])[cH:31][cH:32]4)[n:26]3)[cH:20]2)[cH:12][cH:13][cH:14]1参加物
4
出典と根拠
- ORDレコード
- ord-6abb6ec430f14390aac63108e536d779
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)