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Dimethylformamide → 1-(7-bromo-4-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-(5-(pyridin-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethane-1,2-dione

HRID 2315355
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반응식

HRID 2315355 반응식
[Br:17][c:18]1[n:19][cH:20][c:21]([O:32][CH3:33])[c:22]2[c:23]1[nH:24][cH:25][c:26]2[C:27]([C:28](=[O:29])[OH:30])=[O:31].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[n:1]1[c:2](-[c:7]2[c:8]3[c:13]([cH:14][cH:15][cH:16]2)[CH2:12][NH:11][CH2:10][CH2:9]3)[cH:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2](-[c:7]2[c:8]3[c:13]([cH:14][cH:15][cH:16]2)[CH2:12][N:11]([C:28]([C:27]([c:26]2[c:22]4[c:21]([O:32][CH3:33])[cH:20][n:19][c:18]([Br:17])[c:23]4[nH:24][cH:25]2)=[O:31])=[O:29])[CH2:10][CH2:9]3)[cH:3][cH:4][cH:5][cH:6]1
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5

반응물 4

HCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 56917206HCID 56917206, 화합물HCID 575904972-(7-bromo-4-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-oxoacetic acid

생성물 1

HCID 580260391-(7-bromo-4-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)-2-(5-(pyridin-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethane-1,2-dione

출처 및 근거

ORD 기록
ord-53de139f29964097b713eaee5a43cbf2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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