3-[Bis(4-chlorophenyl)methyl]-7-[(methylsulfinyl)methyl]-1H-indole → 3-[1-(4-Chloro-2-fluorophenyl)-1-(4-fluorophenyl)ethyl]-7-[(methylsulfinyl)methyl]-1H-indole

반응식

[Cl:1][c:2]1[cH:3][c:4]([F:29])[c:5]([C:8]([CH3:9])([c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[c:17]2[cH:18][nH:19][c:20]3[c:21]([CH2:26][S:27][CH3:28])[cH:22][cH:23][cH:24][c:25]23)[cH:6][cH:7]1.[Cl:30][c:31]1[cH:32][cH:33][c:34]([CH:35]([c:36]2[cH:37][cH:38][c:39]([Cl:40])[cH:41][cH:42]2)[c:43]2[c:44]3[c:45]([c:46]([CH2:47][S:48](=[O:49])[CH3:50])[cH:51][cH:52][cH:53]3)[nH:54][cH:55]2)[cH:56][cH:57]1>>[Cl:1][c:2]1[cH:3][c:4]([F:29])[c:5]([C:8]([CH3:9])([c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[c:17]2[cH:18][nH:19][c:20]3[c:21]([CH2:26][S:27]([CH3:28])=[O:49])[cH:22][cH:23][cH:24][c:25]23)[cH:6][cH:7]1

참가 물질

반응물 2

HCID 583921253-[Bis(4-chlorophenyl)methyl]-7-[(methylsulfinyl)methyl]-1H-indole

HCID 583924353-[1-(4-Chloro-2-fluorophenyl)-1-(4-fluorophenyl)ethyl]-7-[(methylsulfanyl)methyl]-1H-indole

생성물 1

HCID 583923083-[1-(4-Chloro-2-fluorophenyl)-1-(4-fluorophenyl)ethyl]-7-[(methylsulfinyl)methyl]-1H-indole

출처 및 근거

ORD 기록: ord-3daf6d6f4473434da115905d5babb0de
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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