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Bicarbonate Ion → N-[3-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-b]pyridazin-6-yl}oxy)phenyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide

HRID 1557623
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HRID 1557623 반응식
[C:39]([O:40][CH2:41][CH3:42])(=[O:43])[CH3:44].[CH3:24][c:25]1[o:26][c:27]([CH3:33])[c:28]([C:30](=[O:31])[Cl:32])[n:29]1.[CH3:50][N:51]([CH3:52])[C:53](=[O:54])[CH3:55].[NH2:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]3[n:10]([n:11]2)[cH:12][c:13]([NH:15][C:16](=[O:17])[CH:18]2[CH2:19][CH2:20]2)[n:14]3)[cH:21][cH:22][cH:23]1.[Na+:45].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH:46][C:47](=[O:48])[O-:49]>>[NH:1]([c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]3[n:10]([n:11]2)[cH:12][c:13]([NH:15][C:16](=[O:17])[CH:18]2[CH2:19][CH2:20]2)[n:14]3)[cH:21][cH:22][cH:23]1)[C:30]([c:28]1[c:27]([CH3:33])[o:26][c:25]([CH3:24])[n:29]1)=[O:31]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 31374DimethylacetamideHCID 70180202,5-Dimethyl-1,3-oxazole-4-carbonyl chlorideHCID 57386059N-[6-(3-aminophenoxy)imidazo[1,2-b]pyridazin-2-yl]cyclopropanecarboxamide

생성물 1

HCID 24767978N-[3-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-b]pyridazin-6-yl}oxy)phenyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide

출처 및 근거

ORD 기록
ord-f7f4bb43c290464ab3faddca22fbe179
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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