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Chloride → Pyridine, 1,2,3,6-tetrahydro-4-(4-chlorophenyl)-1-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-

HRID 155165
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반응식

HRID 155165 반응식
[Cl-:29].[Cl:30][c:31]1[cH:32][cH:33][c:34]([C:37]2=[CH:38][CH2:39][NH:40][CH2:41][CH2:42]2)[cH:35][cH:36]1.[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]2[c:7]([NH:13][c:14]3[cH:15][cH:16][c:17]([C:18](=[O:19])[OH:20])[cH:21][cH:22]3)[cH:8][cH:9][n:10][c:11]2[cH:12]1)([F:23])[F:24].[S:25]([Cl:26])([Cl:27])=[O:28].[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]2[c:7]([NH:13][c:14]3[cH:15][cH:16][c:17]([C:18](=[O:20])[N:40]4[CH2:39][CH:38]=[C:37]([c:34]5[cH:33][cH:32][c:31]([Cl:30])[cH:36][cH:35]5)[CH2:42][CH2:41]4)[cH:21][cH:22]3)[cH:8][cH:9][n:10][c:11]2[cH:12]1)([F:23])[F:24]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 312ChlorideHCID 1049PyridineHCID 24386Thionyl ChlorideHCID 1857174-(4-Chlorophenyl)-1,2,3,6-tetrahydropyridineHCID 135448384-{[7-(Trifluoromethyl)quinolin-4-YL]amino}benzoic acid

생성물 1

HCID 3054996Pyridine, 1,2,3,6-tetrahydro-4-(4-chlorophenyl)-1-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-

출처 및 근거

ORD 기록
ord-e648b33c44b74f9d8abdb21cb7989c26
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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