Toluene → (1H-Benzoimidazol-2-yl)-(6,7,8,9-tetrahydro-5H-benzocyclohepten-5-yl)amine
반응식
[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[Cl:1][c:2]1[nH:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][cH:9][cH:10]2.[cH:11]1[cH:12][cH:13][cH:14][c:15]2[c:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH:21]2[NH2:22]>>[c:2]1([NH:22][CH:21]2[c:15]3[cH:14][cH:13][cH:12][cH:11][c:16]3[CH2:17][CH2:18][CH2:19][CH2:20]2)[nH:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][cH:9][cH:10]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-aac0459b436245e981dca65b87073abc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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