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Dimethylformamide → 1-[1-(2-chloro-6-ethyl-pyrimidin-4-yl)-5-(2,6-dimethyl-phenyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-ethyl-butan-1-one

HRID 305765
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HRID 305765 반응식
[C:35](=[O:36])([O-:37])[O-:38].[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([cH:13][n:14]2)[nH:15][cH:16][c:17]3[C:18]([CH:19]([CH2:20][CH3:21])[CH2:22][CH3:23])=[O:24])[c:4]([CH3:8])[cH:5][cH:6][cH:7]1.[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[Cl:25][c:26]1[n:27][c:28]([CH2:33][CH3:34])[cH:29][c:30]([Cl:32])[n:31]1.[Cs+:39].[Cs+:40].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[CH3:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([cH:13][n:14]2)[n:15](-[c:30]2[cH:29][c:28]([CH2:33][CH3:34])[n:27][c:26]([Cl:25])[n:31]2)[cH:16][c:17]3[C:18]([CH:19]([CH2:20][CH3:21])[CH2:22][CH3:23])=[O:24])[c:4]([CH3:8])[cH:5][cH:6][cH:7]1
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반응물 6

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 2460102,4-Dichloro-6-ethylpyrimidineHCID 671525261-[5-(2,6-dimethyl-phenyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-ethyl-butan-1-one

생성물 1

HCID 86624081
1-[1-(2-chloro-6-ethyl-pyrimidin-4-yl)-5-(2,6-dimethyl-phenyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-ethyl-butan-1-one

출처 및 근거

ORD 기록
ord-8f4ac6fa275144c4be50cd42853c5d6a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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