Thionyl Chloride → 1-(2,3-Dihydrobenzo[1,4]dioxin-2-ylmethyl)piperidine-3-carbonitrile
반응식
[O:1]1[CH:2]([CH2:11][N:12]2[CH2:13][CH:14]([C:18](=[O:19])[NH2:20])[CH2:15][CH2:16][CH2:17]2)[CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2.[S:21]([Cl:22])([Cl:23])=[O:24]>>[O:1]1[CH:2]([CH2:11][N:12]2[CH2:13][CH:14]([C:18]#[N:20])[CH2:15][CH2:16][CH2:17]2)[CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-a381a473ca054a7e9564e97c5d78c375
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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