Acetic Acid → cis-N-(7-chloroquinolin-4-yl)-N'-(quinolin-3-ylmethyl)cyclohexane-1,4-diamine
反応式
[CH3:32][C:33](=[O:34])[OH:35].[CH3:40][OH:41].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([NH:12][CH:13]3[CH2:14][CH2:15][CH:16]([NH2:19])[CH2:17][CH2:18]3)[cH:7][cH:8][n:9][c:10]2[cH:11]1.[Cl:36][CH:37]([Cl:38])[CH3:39].[n:20]1[cH:21][c:22]([CH:30]=[O:31])[cH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]12>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([NH:12][CH:13]3[CH2:14][CH2:15][CH:16]([NH:19][CH2:30][c:22]4[cH:21][n:20][c:29]5[c:24]([cH:23]4)[cH:25][cH:26][cH:27][cH:28]5)[CH2:17][CH2:18]3)[cH:7][cH:8][n:9][c:10]2[cH:11]1参加物
6
出典と根拠
- ORDレコード
- ord-6089a7d98b2d49c297dcfce9f12fbb1d
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
反応ノート
読み込み中…