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Dimethylformamide → (3,4-Dihydro-2H-quinolin-1-yl)-[2-(3-trifluoromethyl-phenoxy)-pyridin-3-yl]-methanone

HRID 2139044
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HRID 2139044 반응식
[CH2:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38])[CH3:39].[F:1][C:2]([c:3]1[cH:4][c:5]([O:6][c:7]2[c:8]([C:9](=[O:10])[OH:11])[cH:12][cH:13][cH:14][n:15]2)[cH:16][cH:17][cH:18]1)([F:19])[F:20].[NH:21]1[CH2:22][CH2:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]21.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([O:6][c:7]2[c:8]([C:9](=[O:11])[N:21]3[CH2:22][CH2:23][CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][c:30]43)[cH:12][cH:13][cH:14][n:15]2)[cH:16][cH:17][cH:18]1)([F:19])[F:20]
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반응물 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 694601,2,3,4-TetrahydroquinolineHCID 81531DiisopropylethylamineHCID 2158912-(3-(Trifluoromethyl)phenoxy)-3-pyridinecarboxylic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

생성물 1

HCID 59294537(3,4-Dihydro-2H-quinolin-1-yl)-[2-(3-trifluoromethyl-phenoxy)-pyridin-3-yl]-methanone

출처 및 근거

ORD 기록
ord-95c8f64b3afb49dabebab31e6cbdb8ab
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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