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Dimethylformamide → 3,3,3-Trifluoro-2-hydroxy-N-(4-oxazol-2-yl-phenyl)-2-[1-(2-trifluoromethyl-phenyl)-cyclobutylmethyl]-propionamide

HRID 305584
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HRID 305584 반응식
[C:32](=[O:33])([O-:34])[O-:35].[CH3:42][SiH:43]([CH3:44])[CH3:45].[CH3:47][CH2:48][CH2:49][CH2:50][N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63].[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[Cs+:36].[Cs+:37].[F-:46].[F:38][CH:39]([F:40])[F:41].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[o:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([NH:12][C:13]([C:14]([CH2:15][C:16]3([c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[CH2:17][CH2:18][CH2:19]3)=[O:30])=[O:31])[cH:10][cH:11]2)[n:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([NH:12][C:13]([C:14]([CH2:15][C:16]3([c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[CH2:17][CH2:18][CH2:19]3)([OH:30])[C:39]([F:38])([F:40])[F:41])=[O:31])[cH:10][cH:11]2)[n:3][cH:4][cH:5]1
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 6228DimethylformamideHCID 6373TrifluoromethaneHCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 28179Fluoride IonHCID 70435TrimethylsilaneHCID 104967Cesium cation
2회
HCID 58897678N-(4-Oxazol-2-yl-phenyl)-2-oxo-3-[1-(2-trifluoromethyl-phenyl)-cyclobutyl]-propionamide

생성물 1

HCID 236415503,3,3-Trifluoro-2-hydroxy-N-(4-oxazol-2-yl-phenyl)-2-[1-(2-trifluoromethyl-phenyl)-cyclobutylmethyl]-propionamide

출처 및 근거

ORD 기록
ord-754404303bcb49a1bc242c5f5784d7ac
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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