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Dimethylformamide → 5-[2,2-Dimethyl-6-(1-methyl-1H-pyrazol-3-ylcarbamoyl)-2,3-dihydro-benzofuran-4-yloxy]-3-fluoro-pyridine-2-carboxylic acid methyl ester

HRID 135222
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반응식

HRID 135222 반응식
[C:34](=[O:35])([O-:36])[O-:37].[CH3:13][n:14]1[n:15][c:16]([NH:19][C:20](=[O:21])[c:22]2[cH:23][c:24]3[c:25]([c:31]([OH:33])[cH:32]2)[CH2:26][C:27]([CH3:29])([CH3:30])[O:28]3)[cH:17][cH:18]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][cH:7][c:8]([F:12])[cH:9][c:10]1[F:11].[Cs+:38].[Cs+:39].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][cH:7][c:8]([O:33][c:31]2[c:25]3[c:24]([cH:23][c:22]([C:20]([NH:19][c:16]4[n:15][n:14]([CH3:13])[cH:18][cH:17]4)=[O:21])[cH:32]2)[O:28][C:27]([CH3:29])([CH3:30])[CH2:26]3)[cH:9][c:10]1[F:11]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 46311137Methyl 3,5-difluoropyridine-2-carboxylateHCID 595600842,3-Dihydro-4-hydroxy-2,2-dimethyl-N-(1-methyl-1H-pyrazol-3-yl)-6-benzofurancarboxamide

생성물 1

HCID 59559964
5-[2,2-Dimethyl-6-(1-methyl-1H-pyrazol-3-ylcarbamoyl)-2,3-dihydro-benzofuran-4-yloxy]-3-fluoro-pyridine-2-carboxylic acid methyl ester

출처 및 근거

ORD 기록
ord-03bee0c717a4404ca2f470bbdc2d9db1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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