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Dimethyl Sulfoxide → N-(7-(2,5-dimethylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl)-4-(2-hydroxypropan-2-yl)benzamide

HRID 212378
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반응식

HRID 212378 반응식
[CH3:24][CH:25]1[NH:26][CH2:27][CH:28]([CH3:31])[NH:29][CH2:30]1.[CH3:32][N:33]1[CH2:34][CH2:35][CH2:36][C:37]1=[O:38].[CH3:39][S:40]([CH3:41])=[O:42].[CH3:43][OH:44].[Cl:1][c:2]1[cH:3][c:4]([NH:11][C:12]([c:13]2[cH:14][cH:15][c:16]([C:19]([CH3:20])([CH3:21])[OH:22])[cH:17][cH:18]2)=[O:23])[n:5][c:6]2[n:7]1[n:8][cH:9][cH:10]2>>[c:2]1([N:26]2[CH:25]([CH3:24])[CH2:30][NH:29][CH:28]([CH3:31])[CH2:27]2)[cH:3][c:4]([NH:11][C:12]([c:13]2[cH:14][cH:15][c:16]([C:19]([CH3:20])([CH3:21])[OH:22])[cH:17][cH:18]2)=[O:23])[n:5][c:6]2[n:7]1[n:8][cH:9][cH:10]2
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반응물 5

HCID 679Dimethyl SulfoxideHCID 887MethanolHCID 78162,5-DimethylpiperazineHCID 13387N-methyl-2-pyrrolidoneHCID 86652272N-(7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-4-(2-hydroxypropan-2-yl)benzamide

생성물 1

HCID 67064565N-(7-(2,5-dimethylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl)-4-(2-hydroxypropan-2-yl)benzamide

출처 및 근거

ORD 기록
ord-19118b10736b4dbd93369bb84809162c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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