Pyridine → N-[5-(5-Chloropyridin-3-ylethynyl)-2-fluorophenyl]-acetamide

반응식

[CH3:1][C:2]([O:3][C:5]([CH3:6])=[O:7])=[O:4].[Cl:8][c:9]1[cH:10][c:11]([C:15]#[C:16][c:17]2[cH:18][cH:19][c:20]([F:24])[c:21]([NH2:23])[cH:22]2)[cH:12][n:13][cH:14]1.[cH:25]1[cH:26][cH:27][n:28][cH:29][cH:30]1>>[C:5]([CH3:6])(=[O:7])[NH:23][c:21]1[c:20]([F:24])[cH:19][cH:18][c:17]([C:16]#[C:15][c:11]2[cH:10][c:9]([Cl:8])[cH:14][n:13][cH:12]2)[cH:22]1

참가 물질

반응물 3

HCID 1049Pyridine

HCID 7918Acetic Anhydride

HCID 670475245-(5-Chloropyridin-3-ylethynyl)-2-fluorophenylamine

생성물 1

HCID 67048115N-[5-(5-Chloropyridin-3-ylethynyl)-2-fluorophenyl]-acetamide

출처 및 근거

ORD 기록: ord-123adc3b481b4aaaa102127a96d6832b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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