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Water → N-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluorophenyl}urea

HRID 110336
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HRID 110336 반응식
[C:43]([CH3:44])(=[O:45])[c:46]1[c:47]([CH3:52])[n:48][c:49]([NH2:51])[s:50]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([F:23])[c:19]([NH2:20])[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH:53]([Cl:54])([Cl:55])[Cl:56].[Cl:31][C:32]([Cl:33])([O:34][C:35]([O:36][C:37]([Cl:38])([Cl:39])[Cl:40])=[O:41])[Cl:42].[OH2:57]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([F:23])[c:19]([NH:20][C:35](=[O:41])[NH:51][c:49]4[n:48][c:47]([CH3:52])[c:46]([C:43]([CH3:44])=[O:45])[s:50]4)[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 962WaterHCID 6212ChloroformHCID 8471TriethylamineHCID 94429TriphosgeneHCID 7208825-Acetyl-2-amino-4-methylthiazoleHCID 113014704-[(6,7-Dimethoxy-4-quinolyl)oxy]-2-fluoroaniline

생성물 1

HCID 22637136
N-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-2-fluorophenyl}urea

출처 및 근거

ORD 기록
ord-fcbf33d8fe834a4eb4ff155c286bb27b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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