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1,10-Phenanthroline → 4-{6-[2-Fluoro-4-(2-methanesulfonyl-ethoxy)-phenylamino]-5-methyl-pyrimidin-4-yloxy}-piperidine-1-carboxylic Acid Isopropyl Ester

HRID 1152991
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HRID 1152991 반응식
[C:30](=[O:31])([O-:32])[O-:33].[CH3:50][S:51](=[O:52])(=[O:53])[CH2:54][CH2:55][OH:56].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:21][c:22]3[c:23]([F:29])[cH:24][c:25]([I:28])[cH:26][cH:27]3)[c:19]2[CH3:20])[CH2:11][CH2:12]1.[Cs+:34].[Cs+:35].[Cu:57]([I:58])[I:59].[n:36]1[c:37]2[c:38]([cH:39][cH:40][c:41]3[c:42]2[n:43][cH:44][cH:45][cH:46]3)[cH:47][cH:48][cH:49]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:21][c:22]3[c:23]([F:29])[cH:24][c:25]([O:56][CH2:55][CH2:54][S:51]([CH3:50])(=[O:52])=[O:53])[cH:26][cH:27]3)[c:19]2[CH3:20])[CH2:11][CH2:12]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 13181,10-PhenanthrolineHCID 19660Carbonate IonHCID 83717Copper iodideHCID 848342-(Methylsulfonyl)ethanolHCID 104967Cesium cation2회HCID 598568514-[6-(2-Fluoro-4-iodo-phenylamino)-5-methyl-pyrimidin-4-yloxy]-piperidine-1-carboxylic Acid Isopropyl Ester

생성물 1

HCID 59856656
4-{6-[2-Fluoro-4-(2-methanesulfonyl-ethoxy)-phenylamino]-5-methyl-pyrimidin-4-yloxy}-piperidine-1-carboxylic Acid Isopropyl Ester

출처 및 근거

ORD 기록
ord-97c4480244d24bc9b99e76935cadd5e1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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