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Sodium Ion → 4-Methyl-[2,2']bipyrimidinyl-5-carboxylic acid (3-ethyl-5-trifluoromethoxy-indol-1-yl)-amide

HRID 2315113
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인쇄 미리보기

반응식

HRID 2315113 반응식
[C:39](=[O:40])([O-:41])[O-:42].[CH2:17]([CH3:18])[c:19]1[cH:20][n:21]([NH2:33])[c:22]2[cH:23][cH:24][c:25]([O:28][C:29]([F:30])([F:31])[F:32])[cH:26][c:27]12.[CH3:1][c:2]1[n:3][c:4](-[c:11]2[n:12][cH:13][cH:14][cH:15][n:16]2)[n:5][cH:6][c:7]1[C:8](=[O:9])[OH:10].[Na+:43].[Na+:44].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38]>>[CH3:1][c:2]1[n:3][c:4](-[c:11]2[n:12][cH:13][cH:14][cH:15][n:16]2)[n:5][cH:6][c:7]1[C:8](=[O:10])[NH:33][n:21]1[cH:20][c:19]([CH2:17][CH3:18])[c:27]2[c:22]1[cH:23][cH:24][c:25]([O:28][C:29]([F:30])([F:31])[F:32])[cH:26]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 923Sodium Ion2회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 616999854-Methyl-2-(pyrimidin-2-yl)pyrimidine-5-carboxylic acidHCID 685555083-ethyl-5-trifluoromethoxy-1H-indol-1-ylamine

생성물 1

HCID 592000004-Methyl-[2,2']bipyrimidinyl-5-carboxylic acid (3-ethyl-5-trifluoromethoxy-indol-1-yl)-amide

출처 및 근거

ORD 기록
ord-bac18353713649db8091102d00016392
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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