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Potassium Cation → N-cyclopropyl-3-[7-[(1-ethylpiperidin-4-yl)oxy]-1-oxoisoquinolin-2(1H)-yl]-4-methylbenzamide

HRID 2332248
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HRID 2332248 반응식
[C:35](=[O:36])([O-:37])[O-:38].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH:1]1([NH:4][C:5]([c:6]2[cH:7][c:8](-[n:13]3[c:14](=[O:30])[c:15]4[cH:16][c:17]([O:23][CH:24]5[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]5)[cH:18][cH:19][c:20]4[cH:21][cH:22]3)[c:9]([CH3:12])[cH:10][cH:11]2)=[O:31])[CH2:2][CH2:3]1.[I:32][CH2:33][CH3:34].[K+:39].[K+:40].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[CH:1]1([NH:4][C:5]([c:6]2[cH:7][c:8](-[n:13]3[c:14](=[O:30])[c:15]4[cH:16][c:17]([O:23][CH:24]5[CH2:25][CH2:26][N:27]([CH2:33][CH3:34])[CH2:28][CH2:29]5)[cH:18][cH:19][c:20]4[cH:21][cH:22]3)[c:9]([CH3:12])[cH:10][cH:11]2)=[O:31])[CH2:2][CH2:3]1
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반응물 6

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 6340IodoethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 67018601N-Cyclopropyl-4-methyl-3-[1-oxo-7-(piperidin-4-yloxy)isoquinolin-2(1H)-yl]benzamide

생성물 1

HCID 11647987
N-cyclopropyl-3-[7-[(1-ethylpiperidin-4-yl)oxy]-1-oxoisoquinolin-2(1H)-yl]-4-methylbenzamide

출처 및 근거

ORD 기록
ord-e7afba93ffa04fe7a8e39e51bd95cc6f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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