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Carbonate Ion → N,N-dimethyl-5-[3-(1-methyl-2-oxopyrrolidin-3-yl)oxy-5-[(5-methylpyrazin-2-yl)carbamoyl]phenoxy]pyridine-2-carboxamide

HRID 1559911
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HRID 1559911 반응식
[Br:26][c:27]1[cH:28][cH:29][c:30]([C:33](=[O:34])[N:35]([CH3:36])[CH3:37])[n:31][cH:32]1.[C:38](=[O:39])([O-:40])[O-:41].[CH3:44][N:45]([CH3:46])[C:47](=[O:48])[CH3:49].[Cs+:42].[Cs+:43].[OH:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[n:9][cH:10][c:11]([CH3:14])[n:12][cH:13]2)[cH:15][c:16]([O:18][CH:19]2[C:20](=[O:25])[N:21]([CH3:24])[CH2:22][CH2:23]2)[cH:17]1>>[O:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[n:9][cH:10][c:11]([CH3:14])[n:12][cH:13]2)[cH:15][c:16]([O:18][CH:19]2[C:20](=[O:25])[N:21]([CH3:24])[CH2:22][CH2:23]2)[cH:17]1)[c:27]1[cH:28][cH:29][c:30]([C:33](=[O:34])[N:35]([CH3:36])[CH3:37])[n:31][cH:32]1
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반응물 5

HCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 104967Cesium cation2회HCID 228316185-bromo-N,N-dimethylpicolinamideHCID 672692353-hydroxy-5-(1-methyl-2-oxopyrrolidin-3-yl)oxy-N-(5-methylpyrazin-2-yl)benzamide

생성물 1

HCID 67486097
N,N-dimethyl-5-[3-(1-methyl-2-oxopyrrolidin-3-yl)oxy-5-[(5-methylpyrazin-2-yl)carbamoyl]phenoxy]pyridine-2-carboxamide

출처 및 근거

ORD 기록
ord-ff385ee6c884432a8e2d62a37035f76a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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