Chloride → 2,3-Diamino-4-[3-(dimethylamino)pyrrolidin-1-yl]-6-methyl-5-phenylbenzonitrile
반응식
[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[Cl-:34].[Cl-:36].[Fe+2:35].[NH2:1][c:2]1[c:3]([C:26]#[N:27])[c:4]([CH3:25])[c:5](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:6]([N:11]2[CH2:12][CH:13]([N:16]([CH3:17])[CH3:18])[CH2:14][CH2:15]2)[c:7]1[N+:8]([O-:9])=[O:10].[OH2:28].[OH2:29].[OH2:30].[OH2:31].[OH2:32].[OH2:33].[Zn:37]>>[NH2:1][c:2]1[c:3]([C:26]#[N:27])[c:4]([CH3:25])[c:5](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:6]([N:11]2[CH2:12][CH:13]([N:16]([CH3:17])[CH3:18])[CH2:14][CH2:15]2)[c:7]1[NH2:8]참가 물질
7
출처 및 근거
- ORD 기록
- ord-d7deddf695c141d19bc726c44a0c659d
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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