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Dichloromethane → 2-phenyl-5-trifluoromethyl-oxazole-4-carboxylic acid [4-(3-trifluoromethyl-phenyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-y]amide

HRID 114880
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HRID 114880 반응식
[CH2:51]([Cl:52])[Cl:53].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[CH:24]([N:25]([CH:26]([CH3:27])[CH3:28])[CH2:29][CH3:30])([CH3:31])[CH3:32].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:9]2[CH2:10][CH2:11][N:12]([c:15]3[n:16][cH:17][c:18]([NH2:21])[cH:19][cH:20]3)[CH2:13][CH2:14]2)[cH:6][cH:7][cH:8]1)([F:22])[F:23].[c:33]1(-[c:39]2[o:40][c:41]([C:47]([F:48])([F:49])[F:50])[c:42]([C:44](=[O:45])[Cl:46])[n:43]2)[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:9]2[CH2:10][CH2:11][N:12]([c:15]3[n:16][cH:17][c:18]([NH:21][C:44]([c:42]4[c:41]([C:47]([F:48])([F:49])[F:50])[o:40][c:39](-[c:33]5[cH:34][cH:35][cH:36][cH:37][cH:38]5)[n:43]4)=[O:45])[cH:19][cH:20]3)[CH2:13][CH2:14]2)[cH:6][cH:7][cH:8]1)([F:22])[F:23]
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참가 물질

6

반응물 5

HCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 593712454-(3-trifluoromethyl-phenyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-ylamineHCID 860328062-Phenyl-5-trifluoromethyl-oxazole-4-carbonyl chloride

생성물 1

HCID 46832908
2-phenyl-5-trifluoromethyl-oxazole-4-carboxylic acid [4-(3-trifluoromethyl-phenyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-y]amide

출처 및 근거

ORD 기록
ord-18b9c5dd4d7246aa90c91d6abbab0ddd
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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