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Acetate → 5-(2-cyanoethenyl)-2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]furo[2,3-b]pyridine-3-carboxamide

HRID 314259
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HRID 314259 반응식
[CH2:28]=[CH:29][C:30]#[N:31].[CH3:1][NH:2][C:3](=[O:4])[c:5]1[c:6](-[c:21]2[cH:22][cH:23][c:24]([F:27])[cH:25][cH:26]2)[o:7][c:8]2[n:9][c:10]([N:15]([CH3:16])[S:17](=[O:18])(=[O:19])[CH3:20])[c:11]([I:14])[cH:12][c:13]12.[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[O-:45][C:46]([CH3:47])=[O:48].[O-:49][C:50]([CH3:51])=[O:52].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[Pd+2:44]>>[CH3:1][NH:2][C:3](=[O:4])[c:5]1[c:6](-[c:21]2[cH:22][cH:23][c:24]([F:27])[cH:25][cH:26]2)[o:7][c:8]2[n:9][c:10]([N:15]([CH3:16])[S:17](=[O:18])(=[O:19])[CH3:20])[c:11]([CH:28]=[CH:29][C:30]#[N:31])[cH:12][c:13]12
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 175Acetate2회HCID 6228DimethylformamideHCID 7855AcrylonitrileHCID 8471TriethylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 545750872-(4-fluorophenyl)-5-iodo-N-methyl-6-(N-methylmethylsulfonamido)furo[2,3-b]pyridine-3-carboxamide

생성물 1

HCID 666638185-(2-cyanoethenyl)-2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]furo[2,3-b]pyridine-3-carboxamide

출처 및 근거

ORD 기록
ord-fbccba9606bf495e9bbb419b02fe9eaf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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