2-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)-7-(2-fluoro-4-nitrophenoxy)thieno[3,2-b]pyridine → 4-((2-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yl)oxy)-3-fluoroaniline

반응식

[O:1]1[CH:2]([c:7]2[cH:8][cH:9][c:10](-[c:13]3[cH:14][c:15]4[n:16][cH:17][cH:18][c:19]([O:22][c:23]5[c:24]([F:30])[cH:25][c:26]([NH2:27])[cH:28][cH:29]5)[c:20]4[s:21]3)[n:11][cH:12]2)[O:3][CH2:4][CH2:5][CH2:6]1.[O:31]1[CH2:32][CH2:33][O:34][CH:35]1[c:36]1[cH:37][cH:38][c:39](-[c:40]2[s:41][c:42]3[c:43]([n:44][cH:45][cH:46][c:47]3[O:48][c:49]3[cH:50][cH:51][c:52]([N+:53]([O-:54])=[O:55])[cH:56][c:57]3[F:58])[cH:59]2)[n:60][cH:61]1>>[O:1]1[CH:2]([c:7]2[cH:8][cH:9][c:10](-[c:13]3[cH:14][c:15]4[n:16][cH:17][cH:18][c:19]([O:22][c:23]5[c:24]([F:30])[cH:25][c:26]([NH2:27])[cH:28][cH:29]5)[c:20]4[s:21]3)[n:11][cH:12]2)[O:3][CH2:4][CH2:5]1

참가 물질

반응물 2

HCID 579194962-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)-7-(2-fluoro-4-nitrophenoxy)thieno[3,2-b]pyridine

HCID 579672584-(2-(5-(1,3-Dioxan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)-3-fluoroaniline

생성물 1

HCID 579195224-((2-(5-(1,3-Dioxolan-2-yl)pyridin-2-yl)thieno[3,2-b]pyridin-7-yl)oxy)-3-fluoroaniline

출처 및 근거

ORD 기록: ord-6a53e821f84847048c0f4ac53ecfe7c2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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