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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Water → N-(5-{[2-(acetylamino)[1,3]thiazolo[5,4-b]pyridin-5-yl]oxy}-4-chloro-2-fluorophenyl)-2-chloro-3-(1-cyano-1-methylethyl)benzamide

HRID 109484
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HRID 109484 반응식
[CH3:16][N:17]([CH3:18])[CH:19]=[O:20].[CH3:51][N:52]([CH3:53])[C:54](=[O:55])[CH3:56].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][cH:9][c:10]1[C:11]([CH3:12])([CH3:13])[C:14]#[N:15].[Cl:45][C:46]([C:47]([Cl:48])=[O:49])=[O:50].[NH2:21][c:22]1[c:23]([F:43])[cH:24][c:25]([Cl:42])[c:26]([O:27][c:28]2[cH:29][cH:30][c:31]3[c:32]([n:33]2)[s:34][c:35]([NH:37][C:38]([CH3:39])=[O:40])[n:36]3)[cH:41]1.[OH2:44]>>[Cl:1][c:2]1[c:3]([C:4](=[O:6])[NH:21][c:22]2[c:23]([F:43])[cH:24][c:25]([Cl:42])[c:26]([O:27][c:28]3[cH:29][cH:30][c:31]4[c:32]([n:33]3)[s:34][c:35]([NH:37][C:38]([CH3:39])=[O:40])[n:36]4)[cH:41]2)[cH:7][cH:8][cH:9][c:10]1[C:11]([CH3:12])([CH3:13])[C:14]#[N:15]
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참가 물질

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반응물 6

HCID 962WaterHCID 6228DimethylformamideHCID 31374DimethylacetamideHCID 65578Oxalyl chlorideHCID 668102752-Chloro-3-(1-cyano-1-methylethyl)benzoic acidHCID 86646021N-[5-(5-amino-2-chloro-4-fluorophenoxy)[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide

생성물 1

HCID 59506956
N-(5-{[2-(acetylamino)[1,3]thiazolo[5,4-b]pyridin-5-yl]oxy}-4-chloro-2-fluorophenyl)-2-chloro-3-(1-cyano-1-methylethyl)benzamide

출처 및 근거

ORD 기록
ord-99d499ba581146c4bdb1efd7617049dd
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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