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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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1,2-Dichloroethane → 4-(4-Chloro-2-fluorophenyl)-N-(6-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide

HRID 671801
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HRID 671801 반응식
[CH2:31]([Cl:32])[CH2:33][Cl:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[Cl:1][c:2]1[cH:3][c:4]([F:19])[c:5]([CH:8]2[C:9]([C:16](=[O:17])[OH:18])=[C:10]([CH3:15])[NH:11][C:12](=[O:14])[CH2:13]2)[cH:6][cH:7]1.[ClH:53].[NH2:20][c:21]1[cH:22][c:23]2[cH:24][n:25][nH:26][c:27]2[cH:28][c:29]1[F:30].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46]>>[Cl:1][c:2]1[cH:3][c:4]([F:19])[c:5]([CH:8]2[C:9]([C:16](=[O:18])[NH:20][c:21]3[cH:22][c:23]4[cH:24][n:25][nH:26][c:27]4[cH:28][c:29]3[F:30])=[C:10]([CH3:15])[NH:11][C:12](=[O:14])[CH2:13]2)[cH:6][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 688260574-(4-Chloro-2-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylic acid

생성물 1

HCID 111659714-(4-Chloro-2-fluorophenyl)-N-(6-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide

출처 및 근거

ORD 기록
ord-62f55fc8f69a4c24b2c9fc7cb7a43747
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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