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Dimethylformamide → 2-{4-[(3-Pyridin-3-ylpyrrolidin-1-yl)carbonyl]isoxazol-5-yl}pyridine

HRID 697508
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HRID 697508 반응식
[B-:12]([F:13])([F:14])([F:15])[F:16].[CH2:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH:39]([CH3:40])[CH3:41])[CH3:42].[NH:1]1[CH2:2][CH:3]([c:6]2[cH:7][n:8][cH:9][cH:10][cH:11]2)[CH2:4][CH2:5]1.[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[n:17]1([O:18][C:19]([N:20]([CH3:21])[CH3:22])=[N+:23]([CH3:24])[CH3:25])[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1.[n:43]1[c:44](-[c:49]2[c:50]([C:54](=[O:55])[OH:56])[cH:51][n:52][o:53]2)[cH:45][cH:46][cH:47][cH:48]1>>[N:1]1([C:54]([c:50]2[c:49](-[c:44]3[n:43][cH:48][cH:47][cH:46][cH:45]3)[o:53][n:52][cH:51]2)=[O:55])[CH2:2][CH:3]([c:6]2[cH:7][n:8][cH:9][cH:10][cH:11]2)[CH2:4][CH2:5]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6228DimethylformamideHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 36136513-(Pyrrolidin-3-yl)pyridineHCID 223090705-(Pyridin-2-yl)-1,2-oxazole-4-carboxylic acid

생성물 1

HCID 59170204
2-{4-[(3-Pyridin-3-ylpyrrolidin-1-yl)carbonyl]isoxazol-5-yl}pyridine

출처 및 근거

ORD 기록
ord-c77aa344c325435fb7452059301c63fa
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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