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Ethyl Acetate → tert-Butyl 4-(4-((2-(6-(4-(ethoxycarbonyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)pyridin-2-yl)-4-methylphenoxy)methyl)phenyl)piperidine-1-carboxylate

HRID 1117381
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HRID 1117381 반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9](-[c:15]2[cH:16][cH:17][cH:18][c:19](-[c:21]3[c:22]([O:23][CH2:24][c:25]4[cH:26][cH:27][c:28]([C:31]5=[CH:36][CH2:35][N:34]([C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[CH2:33][CH2:32]5)[cH:29][cH:30]4)[cH:44][cH:45][c:46]([CH3:48])[cH:47]3)[n:20]2)[c:10]1[C:11]([F:12])([F:13])[F:14].[CH3:51][CH2:52][O:53][C:54]([CH3:55])=[O:56].[H:49][H:50].[Pt:57](=[O:58])=[O:59]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9](-[c:15]2[cH:16][cH:17][cH:18][c:19](-[c:21]3[c:22]([O:23][CH2:24][c:25]4[cH:26][cH:27][c:28]([CH:31]5[CH2:32][CH2:33][N:34]([C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[CH2:35][CH2:36]5)[cH:29][cH:30]4)[cH:44][cH:45][c:46]([CH3:48])[cH:47]3)[n:20]2)[c:10]1[C:11]([F:12])([F:13])[F:14]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 8857Ethyl AcetateHCID 345198Adams' catalystHCID 86644574tert-Butyl 4-(4-((2-(6-(4-(ethoxycarbonyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)pyridin-2-yl)-4-methylphenoxy)methyl)phenyl)-3,6-dihydropyridine-1 (2H)-carboxylateHCID 178418361HCID 178418361, 화합물

생성물 1

HCID 86644575
tert-Butyl 4-(4-((2-(6-(4-(ethoxycarbonyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)pyridin-2-yl)-4-methylphenoxy)methyl)phenyl)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-09ef11502a6443ffb3ea5a4402c71a31
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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