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Dichloromethane → 2-{[4-(2-{[6-(4-Fluorophenyl)pyridazin-3-yl]oxy}ethyl)-1,3-thiazol-2-yl]thio}-2-methylpropionic acid

HRID 1128235
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반응식

HRID 1128235 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([C:7]([CH3:8])([CH3:9])[S:10][c:11]1[s:12][cH:13][c:14]([CH2:16][CH2:17][O:18][c:19]2[n:20][n:21][c:22](-[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[cH:23][cH:24]2)[n:15]1)=[O:32].[Cl:40][CH2:41][Cl:42].[OH:33][C:34]([C:35]([F:36])([F:37])[F:38])=[O:39]>>[O:5]=[C:6]([C:7]([CH3:8])([CH3:9])[S:10][c:11]1[s:12][cH:13][c:14]([CH2:16][CH2:17][O:18][c:19]2[n:20][n:21][c:22](-[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[cH:23][cH:24]2)[n:15]1)[OH:32]
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반응물 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 597592532-{[4-(2-{[6-(4-Fluorophenyl)pyridazin-3-yl]oxy}ethyl)-1,3-thiazol-2-yl]thio}-2-methylpropionic acid tert-butyl ester

생성물 1

HCID 597590412-{[4-(2-{[6-(4-Fluorophenyl)pyridazin-3-yl]oxy}ethyl)-1,3-thiazol-2-yl]thio}-2-methylpropionic acid

출처 및 근거

ORD 기록
ord-3bb29074678b4779904a4558e5f6faac
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D
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