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Dimethylformamide → N-(4-{3-[4-(2,3-Difluoro-phenyl)-isoxazol-5-yl]-1H-pyrrolo[2,3-b]pyridin-5-yl}-cyclohex-3-enyl)-methanesulfonamide

HRID 955081
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HRID 955081 반응식
[F:1][c:2]1[c:3](-[c:9]2[cH:10][n:11][o:12][c:13]2-[c:14]2[cH:15][nH:16][c:17]3[n:18][cH:19][c:20]([C:23]4=[CH:24][CH2:25][CH:26]([NH2:29])[CH2:27][CH2:28]4)[cH:21][c:22]23)[cH:4][cH:5][cH:6][c:7]1[F:8].[F:44][C:45]([F:46])([F:47])[C:48]([OH:49])=[O:50].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[n:30]1([O:39][S:40](=[O:31])(=[O:41])[CH3:43])[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:42]1>>[F:1][c:2]1[c:3](-[c:9]2[cH:10][n:11][o:12][c:13]2-[c:14]2[cH:15][nH:16][c:17]3[n:18][cH:19][c:20]([C:23]4=[CH:24][CH2:25][CH:26]([NH:29][S:40](=[O:39])(=[O:41])[CH3:43])[CH2:27][CH2:28]4)[cH:21][c:22]23)[cH:4][cH:5][cH:6][c:7]1[F:8]
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반응물 4

HCID 6228DimethylformamideHCID 6422Trifluoroacetic acidHCID 11745953Methanesulfonic acid, 1H-benzotriazol-1-yl esterHCID 1354403634-{3-[4-(2,3-difluoro-phenyl)-isoxazol-5-yl]-1H-pyrrolo [2,3-b]pyridin-5-yl}-cyclohex-3-enylamine

생성물 1

HCID 135451017N-(4-{3-[4-(2,3-Difluoro-phenyl)-isoxazol-5-yl]-1H-pyrrolo[2,3-b]pyridin-5-yl}-cyclohex-3-enyl)-methanesulfonamide

출처 및 근거

ORD 기록
ord-2be157be1c254bc29f3c857d60e3a9e5
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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