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Water → 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(3-(trifluoromethoxy)phenyl)-1,2,4-oxadiazole-5-carboxamide

HRID 2346406
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HRID 2346406 반응식
[Br:17][c:18]1[cH:19][c:20](-[c:26]2[n:27][o:28][c:29]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[n:30]2)[cH:21][c:22]([Br:25])[c:23]1[OH:24].[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42].[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[F:5][C:6]([O:7][c:8]1[cH:9][c:10]([NH2:11])[cH:12][cH:13][cH:14]1)([F:15])[F:16].[OH2:36]>>[F:5][C:6]([O:7][c:8]1[cH:9][c:10]([NH:11][C:31]([c:29]2[o:28][n:27][c:26](-[c:20]3[cH:19][c:18]([Br:17])[c:23]([OH:24])[c:22]([Br:25])[cH:21]3)[n:30]2)=[O:32])[cH:12][cH:13][cH:14]1)([F:15])[F:16]
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반응물 6

HCID 962WaterHCID 1140TolueneHCID 8058HexaneHCID 737533-(Trifluoromethoxy)anilineHCID 16682925TrimethylaluminumHCID 136139598Ethyl 3-(3,5-dibromo-4-hydroxyphenyl)-1,2,4-oxadiazole-5-carboxylate

생성물 1

HCID 135870516
3-(3,5-Dibromo-4-hydroxyphenyl)-N-(3-(trifluoromethoxy)phenyl)-1,2,4-oxadiazole-5-carboxamide

출처 및 근거

ORD 기록
ord-46d7f5327cda41bcaf46ad84e2ad3d3e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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