2-Cyanobenzaldehyde → 2-[[4-[3-(Trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-yl]methyl]benzonitrile
반응식
[CH:21](=[O:22])[c:23]1[c:24]([C:25]#[N:26])[cH:27][cH:28][cH:29][cH:30]1.[N:1]1([c:8]2[cH:9][cH:10][c:11]3[n:12]([n:13]2)[c:14]([C:17]([F:18])([F:19])[F:20])[n:15][n:16]3)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6][CH2:7]1>>[N:1]1([c:8]2[cH:9][cH:10][c:11]3[n:12]([n:13]2)[c:14]([C:17]([F:18])([F:19])[F:20])[n:15][n:16]3)[CH2:2][CH2:3][N:4]([CH2:21][c:23]2[c:24]([C:25]#[N:26])[cH:27][cH:28][cH:29][cH:30]2)[CH2:5][CH2:6][CH2:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-7411f13c30544adf82f7ba101a5a5f7b
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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