Hydrochloric Acid → 4-(8-Azabicyclo[3.2.1]oct-8-yl)-3-(trifluoromethyl)benzonitrile
반응식
[CH3:32][S:33]([CH3:34])=[O:35].[CH:15]12[CH2:16][CH2:17][CH2:18][CH:19]([CH2:20][CH2:21]1)[NH:22]2.[CH:23]([N:24]([CH2:25][CH3:26])[CH:27]([CH3:28])[CH3:29])([CH3:30])[CH3:31].[ClH:14].[F:1][c:2]1[c:3]([C:10]([F:11])([F:12])[F:13])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1>>[c:2]1([N:22]2[CH:15]3[CH2:16][CH2:17][CH2:18][CH:19]2[CH2:20][CH2:21]3)[c:3]([C:10]([F:11])([F:12])[F:13])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-3ab5a6010e1445ad9809b5e249f9614f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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