HCID 10195121, 화합물 → 2-(6-((4-Methyl-2-(4-(trifluoromethyl)phenyl)thiazol-5-yl)methoxy)benzo[b]thiophen-3-yl)acetic acid

반응식

[CH3:1][O:2][C:3]([CH2:4][c:5]1[c:6]2[c:7]([s:8][cH:9]1)[cH:10][c:11]([O:14][CH2:15][c:16]1[c:17]([CH3:31])[n:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]3)[s:20]1)[cH:12][cH:13]2)=[O:32].[CH3:33][c:34]1[n:35][c:36](-[c:37]2[cH:38][cH:39][c:40]([C:41]([F:42])([F:43])[F:44])[cH:45][cH:46]2)[s:47][c:48]1[CH2:49][S:50][c:51]1[cH:52][cH:53][c:54]2[o:55][c:56]([C:57]([OH:58])=[O:59])[cH:60][c:61]2[cH:62]1>>[O:2]=[C:3]([CH2:4][c:5]1[c:6]2[c:7]([s:8][cH:9]1)[cH:10][c:11]([O:14][CH2:15][c:16]1[c:17]([CH3:31])[n:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]3)[s:20]1)[cH:12][cH:13]2)[OH:32]

참가 물질

반응물 2

HCID 10195121HCID 10195121, 화합물

HCID 20765976{6-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethoxy]-benzo[b]thiophen-3-yl}-acetic acid methyl ester

생성물 1

HCID 102171912-(6-((4-Methyl-2-(4-(trifluoromethyl)phenyl)thiazol-5-yl)methoxy)benzo[b]thiophen-3-yl)acetic acid

출처 및 근거

ORD 기록: ord-e5d01672c74848489b360fdd73720653
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…