3-[9-(2,2,2-Trifluoroethylcarbamoyl)-9H-fluoren-9-yl]propyl bromide → 2-(Tetrahydropyran-2-yl)methyl-7-[4-[3-[9-(2,2,2-trifluoroethylcarbamoyl)-9H-fluoren-9-yl]propyl]piperazin-1-yl]-3,4-dihydro-2H-isoquinolin-1-one
반응식
[F:32][C:33]([CH2:34][NH:35][C:36](=[O:37])[C:38]1([CH2:51][CH2:52][CH2:53][Br:54])[c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2-[c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]21)([F:55])[F:56].[O:1]1[CH:2]([CH2:7][N:8]2[C:9](=[O:31])[c:10]3[cH:11][c:12]([N:18]4[CH2:19][CH2:20][N:21]([C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH2:22][CH2:23]4)[cH:13][cH:14][c:15]3[CH2:16][CH2:17]2)[CH2:3][CH2:4][CH2:5][CH2:6]1>>[O:1]1[CH:2]([CH2:7][N:8]2[C:9](=[O:31])[c:10]3[cH:11][c:12]([N:18]4[CH2:19][CH2:20][N:21]([CH2:53][CH2:52][CH2:51][C:38]5([C:36]([NH:35][CH2:34][C:33]([F:32])([F:55])[F:56])=[O:37])[c:39]6[cH:40][cH:41][cH:42][cH:43][c:44]6-[c:45]6[cH:46][cH:47][cH:48][cH:49][c:50]65)[CH2:22][CH2:23]4)[cH:13][cH:14][c:15]3[CH2:16][CH2:17]2)[CH2:3][CH2:4][CH2:5][CH2:6]1참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-9936b8f5846a4e958bbdb588b4a30612
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)