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Dimethylformamide → N-(3-{[2-(isobutyrylamino)imidazo[1,2-b]pyridazin-6-yl]oxy}phenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide

HRID 116622
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HRID 116622 반응식
[CH3:11][N:12]([CH3:13])[CH:14]=[O:15].[CH3:1][n:2]1[n:3][c:4]([CH3:10])[cH:5][c:6]1[C:7](=[O:8])[OH:9].[CH3:45][N:46]([CH3:47])[C:48](=[O:49])[CH3:50].[Cl:16][C:17]([C:18]([Cl:19])=[O:20])=[O:21].[NH2:22][c:23]1[cH:24][c:25]([O:26][c:27]2[cH:28][cH:29][c:30]3[n:31]([n:32]2)[cH:33][c:34]([NH:36][C:37]([CH:38]([CH3:39])[CH3:40])=[O:41])[n:35]3)[cH:42][cH:43][cH:44]1.[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1>>[CH3:1][n:2]1[n:3][c:4]([CH3:10])[cH:5][c:6]1[C:7](=[O:9])[NH:22][c:23]1[cH:24][c:25]([O:26][c:27]2[cH:28][cH:29][c:30]3[n:31]([n:32]2)[cH:33][c:34]([NH:36][C:37]([CH:38]([CH3:39])[CH3:40])=[O:41])[n:35]3)[cH:42][cH:43][cH:44]1
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반응물 6

HCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 31374DimethylacetamideHCID 65578Oxalyl chlorideHCID 5877211,3-Dimethyl-1H-pyrazole-5-carboxylic acidHCID 57505515N-[6-(3-aminophenoxy)imidazo[1,2-b]pyridazin-2-yl]-2-methylpropanamide

생성물 1

HCID 57505516
N-(3-{[2-(isobutyrylamino)imidazo[1,2-b]pyridazin-6-yl]oxy}phenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide

출처 및 근거

ORD 기록
ord-fe58a7d448bd4ce4b006365486f7e42a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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