Magnesium Cation → (E)-4-((1-methyl-1H-imidazol-2-yl)methyleneamino)isobenzofuran-1(3H)-one
반응식
[CH3:1][n:2]1[c:3]([CH:7]=[O:8])[n:4][cH:5][cH:6]1.[CH3:26][C:27]#[N:28].[Mg+2:20].[NH2:9][c:10]1[c:11]2[c:15]([cH:16][cH:17][cH:18]1)[C:14](=[O:19])[O:13][CH2:12]2.[O-:21][S:22](=[O:23])(=[O:24])[O-:25]>>[CH3:1][n:2]1[c:3]([CH:7]=[N:9][c:10]2[c:11]3[c:15]([cH:16][cH:17][cH:18]2)[C:14](=[O:19])[O:13][CH2:12]3)[n:4][cH:5][cH:6]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-cecebb4e9d4d44869fa4763e7316aeba
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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