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1,2-Dichloroethane → N-(6-Fluoro-1H-indazol-5-yl)-4-[2-fluoro-4-(trifluoromethyl)phenyl]-1,2-dimethyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide

HRID 199107
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HRID 199107 반응식
[CH2:35]([Cl:36])[CH2:37][Cl:38].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:51][CH2:52][O:53][C:54]([CH3:55])=[O:56].[ClH:57].[F:1][c:2]1[c:3]([CH:12]2[C:13]([C:21](=[O:22])[OH:23])=[C:14]([CH3:20])[N:15]([CH3:19])[C:16](=[O:18])[CH2:17]2)[cH:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[NH2:24][c:25]1[cH:26][c:27]2[cH:28][n:29][nH:30][c:31]2[cH:32][c:33]1[F:34].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50]>>[F:1][c:2]1[c:3]([CH:12]2[C:13]([C:21](=[O:23])[NH:24][c:25]3[cH:26][c:27]4[cH:28][n:29][nH:30][c:31]4[cH:32][c:33]3[F:34])=[C:14]([CH3:20])[N:15]([CH3:19])[C:16](=[O:18])[CH2:17]2)[cH:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1
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참가 물질

8

반응물 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 450905046-fluoro-1H-indazol-5-amineHCID 690027054-[2-Fluoro-4-(trifluoromethyl)phenyl]-1,2-dimethyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylic acid

생성물 1

HCID 11476792N-(6-Fluoro-1H-indazol-5-yl)-4-[2-fluoro-4-(trifluoromethyl)phenyl]-1,2-dimethyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide

출처 및 근거

ORD 기록
ord-3c00da231be34462a71197e260a5f206
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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