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Dimethylformamide → 5-fluoro-N-(trans-4-hydroxy-cyclohexyl)-2-(4-methylsulfanyl-3-methoxy-phenoxy)-nicotinamide

HRID 177710
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인쇄 미리보기

반응식

HRID 177710 반응식
[C:30](=[O:31])([O-:32])[O-:33].[CH3:19][S:20][c:21]1[c:22]([O:28][CH3:29])[cH:23][c:24]([OH:27])[cH:25][cH:26]1.[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH:7]2[CH2:8][CH2:9][CH:10]([OH:13])[CH2:11][CH2:12]2)[cH:14][c:15]([F:18])[cH:16][n:17]1.[Cs+:34].[Cs+:35].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40]>>[c:2]1([O:27][c:24]2[cH:23][c:22]([O:28][CH3:29])[c:21]([S:20][CH3:19])[cH:26][cH:25]2)[c:3]([C:4](=[O:5])[NH:6][CH:7]2[CH2:8][CH2:9][CH:10]([OH:13])[CH2:11][CH2:12]2)[cH:14][c:15]([F:18])[cH:16][n:17]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 218771303-Methoxy-4-(methylsulfanyl)phenolHCID 218771652-Chloro-5-fluoro-N-(trans-4-hydroxycyclohexyl)nicotinamide

생성물 1

HCID 218772015-fluoro-N-(trans-4-hydroxy-cyclohexyl)-2-(4-methylsulfanyl-3-methoxy-phenoxy)-nicotinamide

출처 및 근거

ORD 기록
ord-0a23e705c2e940119a6fda7ff8dfc5db
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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