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Dimethylformamide → N-(6-Acetoxy-7,8-dihydro-6H-pyrrolo[2',1':2,3]imidazo[4,5-b]pyridin-3-yl)-5-fluoro-1-(3-fluorobenzyl)-1H-indole-2-carboxamide

HRID 691244
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HRID 691244 반응식
[C:33]([CH3:34])(=[O:35])[O:36][CH:37]1[CH2:38][CH2:39][n:40]2[c:41]1[n:42][c:43]1[c:44]2[n:45][cH:46][c:47]([NH2:49])[cH:48]1.[CH3:22][N:23]([CH3:24])[CH2:25][CH2:26][CH2:27][N:28]=[C:29]=[N:30][CH2:31][CH3:32].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[F:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:19](=[O:20])[OH:21])[n:7]([CH2:11][c:12]3[cH:13][c:14]([F:18])[cH:15][cH:16][cH:17]3)[c:8]2[cH:9][cH:10]1>>[F:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:19](=[O:20])[NH:49][c:47]3[cH:46][n:45][c:44]4[n:40]5[c:41]([n:42][c:43]4[cH:48]3)[CH:37]([O:36][C:33]([CH3:34])=[O:35])[CH2:38][CH2:39]5)[n:7]([CH2:11][c:12]3[cH:13][c:14]([F:18])[cH:15][cH:16][cH:17]3)[c:8]2[cH:9][cH:10]1
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반응물 4

HCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 574315135-fluoro-1-(3-fluorobenzyl)-1H-indole-2-carboxylic acidHCID 594026426-acetoxy-7,8-dihydro-6H-pyrrolo[2',1':2,3]imidazo[4,5-b]pyridin-3-amine

생성물 1

HCID 66905274N-(6-Acetoxy-7,8-dihydro-6H-pyrrolo[2',1':2,3]imidazo[4,5-b]pyridin-3-yl)-5-fluoro-1-(3-fluorobenzyl)-1H-indole-2-carboxamide

출처 및 근거

ORD 기록
ord-70ee79f83ab044b29489b7b5b7d00d27
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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