Sodium ion → 3-(4-Methyl-1H-imidazol-1-YL)-5-(trifluoromethyl)benzonitrile
반응식
[CH3:1][c:2]1[n:3][cH:4][nH:5][cH:6]1.[CH3:23][N:24]1[CH2:25][CH2:26][CH2:27][C:28]1=[O:29].[F:9][c:10]1[cH:11][c:12]([C:13]#[N:14])[cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1.[H-:7].[Na+:8].[OH2:22]>>[CH3:1][c:2]1[n:3][cH:4][n:5](-[c:10]2[cH:11][c:12]([C:13]#[N:14])[cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)[cH:6]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-9a0984756b4f4d5791e5e3097edfe693
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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