Benzaldehyde → 6-Benzyl-3-(4-fluoro-phenyl)-2-isopropyl-2,4,5,6,7,8-hexahydro-1,2,6-triaza-azulene
반응식
[CH:21](=[O:22])[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9]([CH:18]([CH3:19])[CH3:20])[n:10][c:11]3[c:17]2[CH2:16][CH2:15][NH:14][CH2:13][CH2:12]3)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9]([CH:18]([CH3:19])[CH3:20])[n:10][c:11]3[c:17]2[CH2:16][CH2:15][N:14]([CH2:21][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:13][CH2:12]3)[cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-23c1307a78fb4e318fb6a3e564ed347f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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