Acetic Acid → N-(3-Fluoro-4-(2-(5-formylpyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-(4-fluorophenyl)acetamide

반응식

[CH3:44][C:45](=[O:46])[OH:47].[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:43])[cH:25][c:26]([NH:29][C:30](=[S:31])[NH:32][C:33]([CH2:34][c:35]6[cH:36][cH:37][c:38]([F:41])[cH:39][cH:40]6)=[O:42])[cH:27][cH:28]5)[c:20]4[s:21]3)[n:11][cH:12]2)[O:6][CH2:5][CH2:4][CH2:3]1>>[O:1]=[CH:2][c:7]1[cH:8][cH:9][c:10](-[c:13]2[cH:14][c:15]3[n:16][cH:17][cH:18][c:19]([O:22][c:23]4[c:24]([F:43])[cH:25][c:26]([NH:29][C:30](=[S:31])[NH:32][C:33]([CH2:34][c:35]5[cH:36][cH:37][c:38]([F:41])[cH:39][cH:40]5)=[O:42])[cH:27][cH:28]4)[c:20]3[s:21]2)[n:11][cH:12]1

참가 물질

반응물 2

HCID 176Acetic Acid

HCID 57967274HCID 57967274, 화합물

생성물 1

HCID 25212245N-(3-Fluoro-4-(2-(5-formylpyridin-2-yl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-(4-fluorophenyl)acetamide

출처 및 근거

ORD 기록: ord-0211883459e44f07858d7434b6e1035b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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