4-Methyl-2-nitroaniline → 5-Methyl-2-(2-phenylethenyl)-1-pyridin-2-ylbenzimidazole
반응식
[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH2:6])[c:7]([N+:8]([O-:9])=[O:10])[cH:11]1.[n:12]1[c:13](-[n:18]2[c:19]([CH:31]=[CH:32][c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[n:20][c:21]3[c:22]2[cH:23][cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]3)[cH:14][cH:15][cH:16][cH:17]1>>[n:12]1[c:13](-[n:18]2[c:19]([CH:31]=[CH:32][c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[n:20][c:21]3[c:22]2[cH:23][cH:24][c:25]([CH3:27])[cH:26]3)[cH:14][cH:15][cH:16][cH:17]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-95b9cec0d2ea482390005037ef15a0a0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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