反応式
[C:27]([CH3:28])([CH3:29])([CH3:30])[N:31]=[C:32]=[O:33].[NH2:1][c:2]1[c:3](-[c:19]2[c:20]([Cl:26])[cH:21][cH:22][cH:23][c:24]2[Cl:25])[cH:4][c:5]2[c:6]([n:7][c:8]([NH:11][CH2:12][CH2:13][CH2:14][N:15]([CH3:16])[CH3:17])[n:9][cH:10]2)[n:18]1>>[NH:1]([c:2]1[c:3](-[c:19]2[c:20]([Cl:26])[cH:21][cH:22][cH:23][c:24]2[Cl:25])[cH:4][c:5]2[c:6]([n:7][c:8]([NH:11][CH2:12][CH2:13][CH2:14][N:15]([CH3:16])[CH3:17])[n:9][cH:10]2)[n:18]1)[C:32]([NH:31][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:33]参加物
3
出典と根拠
- ORDレコード
- ord-8516aeea1645495a82ee44306b1d5a2c
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
関連ノート
読み込み中…