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Dimethyl Sulfoxide → 4-(2-Piperidin-1-yl-ethoxy)-6-(3-trifluoromethyl-phenyl)-pyrimidine-2-carbonitrile

HRID 2312602
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HRID 2312602 반응식
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[n:6][c:7](-[c:20]2[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]2)[cH:8][c:9]([O:11][CH2:12][CH2:13][N:14]2[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]2)[n:10]1.[CH3:33][S:34]([CH3:35])=[O:36].[CH3:37][C:38]#[N:39].[Na:30][C:31]#[N:32]>>[c:5]1([C:31]#[N:32])[n:6][c:7](-[c:20]2[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]2)[cH:8][c:9]([O:11][CH2:12][CH2:13][N:14]2[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]2)[n:10]1
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5

반응물 4

HCID 679Dimethyl SulfoxideHCID 6342AcetonitrileHCID 688229302-Methanesulfonyl-4-(2-piperidin-1-yl-ethoxy)-6-(3-trifluoromethyl phenyl)-pyrimidineHCID 178511850HCID 178511850, 화합물

생성물 1

HCID 161193874-(2-Piperidin-1-yl-ethoxy)-6-(3-trifluoromethyl-phenyl)-pyrimidine-2-carbonitrile

출처 및 근거

ORD 기록
ord-c4e27011bea84bca8559095e61fbe58d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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