3-[Bis(4-chlorophenyl)methyl]-7-[(methylsulfinyl)methyl]-1H-indole → 3-[(4-Chlorophenyl)(4-fluorophenyl)methyl]-5-fluoro-7-[(methylsulfinyl)methyl]-1H-indole
반응식
[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([c:9]2[cH:10][nH:11][c:12]3[c:13]([CH2:19][S:20][CH3:21])[cH:14][c:15]([F:18])[cH:16][c:17]23)[c:22]2[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]2)[cH:6][cH:7]1.[Cl:29][c:30]1[cH:31][cH:32][c:33]([CH:34]([c:35]2[cH:36][cH:37][c:38]([Cl:39])[cH:40][cH:41]2)[c:42]2[c:43]3[c:44]([c:45]([CH2:46][S:47](=[O:48])[CH3:49])[cH:50][cH:51][cH:52]3)[nH:53][cH:54]2)[cH:55][cH:56]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([c:9]2[cH:10][nH:11][c:12]3[c:13]([CH2:19][S:20]([CH3:21])=[O:48])[cH:14][c:15]([F:18])[cH:16][c:17]23)[c:22]2[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]2)[cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-12826211e2fc43ce8e5d5e01519bf577
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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