Methyl 2-(4-(bromomethyl)phenyl)acetate → {4-[5-Chloro-2-(1-cyclohexylmethyl-5,6-difluoro-1H-benzoimidazol-2-yl)-phenoxymethyl]-phenyl}-acetic acid methyl ester

반응식

[CH3:27][O:28][C:29]([CH2:30][c:31]1[cH:32][cH:33][c:34]([CH2:37][Br:38])[cH:35][cH:36]1)=[O:39].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:9]2[n:10][c:11]3[c:12]([n:13]2[CH2:14][CH:15]2[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]2)[cH:21][c:22]([F:26])[c:23]([F:25])[cH:24]3)[c:6]([OH:8])[cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:9]2[n:10][c:11]3[c:12]([n:13]2[CH2:14][CH:15]2[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]2)[cH:21][c:22]([F:26])[c:23]([F:25])[cH:24]3)[c:6]([O:8][CH2:37][c:34]2[cH:33][cH:32][c:31]([CH2:30][C:29]([O:28][CH3:27])=[O:39])[cH:36][cH:35]2)[cH:7]1

참가 물질

반응물 2

HCID 11770640Methyl 2-(4-(bromomethyl)phenyl)acetate

HCID 1363784785-chloro-2-(1-cyclohexylmethyl-5,6-difluoro-1H-benzoimidazol-2-yl)-phenol

생성물 1

HCID 67049944{4-[5-Chloro-2-(1-cyclohexylmethyl-5,6-difluoro-1H-benzoimidazol-2-yl)-phenoxymethyl]-phenyl}-acetic acid methyl ester

출처 및 근거

ORD 기록: ord-68eda9a84190499b90529e97e38e3894
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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