Tetrahydrofuran → 6-(2-Amino-pyrimidin-4-yloxy)-benzo[d]isothiazole-3-carboxylic acid (4-fluoro-3-trifluoromethyl-phenyl)-amide
반응식
[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[F:1][c:2]1[c:3]([C:29]([F:30])([F:31])[F:32])[cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][s:13][c:14]3[c:15]2[cH:16][cH:17][c:18]([O:20][c:21]2[n:22][c:23]([NH2:28])[n:24][c:25]([Cl:27])[cH:26]2)[cH:19]3)[cH:6][cH:7]1>>[F:1][c:2]1[c:3]([C:29]([F:30])([F:31])[F:32])[cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][s:13][c:14]3[c:15]2[cH:16][cH:17][c:18]([O:20][c:21]2[n:22][c:23]([NH2:28])[n:24][cH:25][cH:26]2)[cH:19]3)[cH:6][cH:7]1참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-0a5f130202fd43e4952cbc7674159c6c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)