N-Methylbenzeneethanamine → N-methyl-N-(2-phenylethyl)-2-{4-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]phenyl}acetamide
반응식
[CH3:24][NH:25][CH2:26][CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[F:1][C:2]([c:3]1[n:4][n:5](-[c:12]2[cH:13][cH:14][c:15]([CH2:18][C:19](=[O:20])[OH:21])[cH:16][cH:17]2)[c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][CH2:7]2)([F:22])[F:23]>>[F:1][C:2]([c:3]1[n:4][n:5](-[c:12]2[cH:13][cH:14][c:15]([CH2:18][C:19](=[O:21])[N:25]([CH3:24])[CH2:26][CH2:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:16][cH:17]2)[c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][CH2:7]2)([F:22])[F:23]참가 물질
3
출처 및 근거
- ORD 기록
- ord-4c87d52a2593470d898d66847f098898
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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