Trifluoroacetic acid → N-(5-Chloropyridin-2-yl)-3-[4-(methylthio)-2-(piperidin-4-yloxy)benzoylamino]pyridine-2-carboxamide

반응식

[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[c:16]([C:17](=[O:18])[NH:19][c:20]3[c:21]([C:26](=[O:27])[NH:28][c:29]4[n:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]4)[n:22][cH:23][cH:24][cH:25]3)[cH:36][cH:37][c:38]([S:40][CH3:41])[cH:39]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[F:42][C:43]([F:44])([F:45])[C:46]([OH:47])=[O:48]>>[NH:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[c:16]([C:17](=[O:18])[NH:19][c:20]3[c:21]([C:26](=[O:27])[NH:28][c:29]4[n:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]4)[n:22][cH:23][cH:24][cH:25]3)[cH:36][cH:37][c:38]([S:40][CH3:41])[cH:39]2)[CH2:12][CH2:13]1

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 116999433-[2-(1-tert-Butoxycarbonylpiperidin-4-yloxy)-4-(methylthio)benzoylamino]-N-(5-chloropyridin-2-yl)pyridine-2-carboxamide

생성물 1

HCID 11620252N-(5-Chloropyridin-2-yl)-3-[4-(methylthio)-2-(piperidin-4-yloxy)benzoylamino]pyridine-2-carboxamide

출처 및 근거

ORD 기록: ord-4512de37a30447d388d4c824c940e624
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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