Dichloromethane → 5-(4-Amino-6-methyl-1,3,5-triazin-2-YL)-6-(5-fluoro-6-methoxypyridin-3-ylamino)nicotinaldehyde
反応式
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([c:9]2[n:10][c:11](-[c:16]3[c:17]([NH:24][c:25]4[cH:26][n:27][c:28]([O:32][CH3:33])[c:29]([F:31])[cH:30]4)[n:18][cH:19][c:20]([CH:21]=[O:22])[cH:23]3)[n:12][c:13]([CH3:15])[n:14]2)[CH2:34][c:35]2[cH:36][cH:37][c:38]([O:39][CH3:40])[cH:41][cH:42]2)[cH:43][cH:44]1.[Cl:52][CH2:53][Cl:54].[F:45][C:46]([F:47])([F:48])[C:49]([OH:50])=[O:51]>>[NH2:8][c:9]1[n:10][c:11](-[c:16]2[c:17]([NH:24][c:25]3[cH:26][n:27][c:28]([O:32][CH3:33])[c:29]([F:31])[cH:30]3)[n:18][cH:19][c:20]([CH:21]=[O:22])[cH:23]2)[n:12][c:13]([CH3:15])[n:14]1参加物
4
出典と根拠
- ORDレコード
- ord-62b9d3c08d1d41c9944c011b3d4e00db
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
- DOI