Methanol → 5-[[1-[3-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl]oxy]pyridine-2-carbonitrile
반응식
[CH3:37][OH:38].[Cl:23][c:24]1[cH:25][cH:26][c:27]([C:30]#[N:31])[n:28][cH:29]1.[F:1][C:2]([c:3]1[n:4][n:5][c:6]2[n:7]1[n:8][c:9]([N:12]1[CH2:13][CH2:14][CH:15]([OH:18])[CH2:16][CH2:17]1)[cH:10][cH:11]2)([F:19])[F:20].[H-:21].[Na+:22].[O:32]=[CH:33][N:34]([CH3:35])[CH3:36]>>[F:1][C:2]([c:3]1[n:4][n:5][c:6]2[n:7]1[n:8][c:9]([N:12]1[CH2:13][CH2:14][CH:15]([O:18][c:24]3[cH:25][cH:26][c:27]([C:30]#[N:31])[n:28][cH:29]3)[CH2:16][CH2:17]1)[cH:10][cH:11]2)([F:19])[F:20]참가 물질
7
반응물 6
생성물 1
출처 및 근거
- ORD 기록
- ord-fad166910558483988922d6c75d8c0c3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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