2-(4-(3-Chlorophenyl)piperazin-1-yl)ethan-1-amine → 1-t-Butyl-5-iso-butyl-3-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}aminomethylpyrazole
반응식
[C:17]([CH3:18])([CH3:19])([CH3:20])[n:21]1[n:22][c:23]([CH:30]=[O:31])[cH:24][c:25]1[CH2:26][CH:27]([CH3:28])[CH3:29].[Cl:1][c:2]1[cH:3][c:4]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][NH2:16])[CH2:12][CH2:13]2)[cH:5][cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][c:4]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][NH:16][CH2:30][c:23]3[n:22][n:21]([C:17]([CH3:18])([CH3:19])[CH3:20])[c:25]([CH2:26][CH:27]([CH3:28])[CH3:29])[cH:24]3)[CH2:12][CH2:13]2)[cH:5][cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-2af8a7a3fa2f444f9650f40fceae1214
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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