Pyridine → N-[2-chloro-5-(3-dimethylaminobenzamido)4-fluorophenyl]-3,4-dimethoxybenzamide

반응식

[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[Cl:8])[cH:9][cH:10][c:11]1[O:12][CH3:13].[NH2:14][c:15]1[c:16]([Cl:34])[cH:17][c:18]([F:33])[c:19]([NH:21][C:22]([c:23]2[cH:24][c:25]([N:29]([CH3:30])[CH3:31])[cH:26][cH:27][cH:28]2)=[O:32])[cH:20]1.[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[NH:14][c:15]2[c:16]([Cl:34])[cH:17][c:18]([F:33])[c:19]([NH:21][C:22]([c:23]3[cH:24][c:25]([N:29]([CH3:30])[CH3:31])[cH:26][cH:27][cH:28]3)=[O:32])[cH:20]2)[cH:9][cH:10][c:11]1[O:12][CH3:13]

참가 물질

반응물 3

HCID 1049Pyridine

HCID 77070Veratroyl chloride

HCID 22732310N-(5-amino-4-chloro-2-fluorophenyl)-3-dimethylaminobenzamide

생성물 1

HCID 9847600N-[2-chloro-5-(3-dimethylaminobenzamido)4-fluorophenyl]-3,4-dimethoxybenzamide

출처 및 근거

ORD 기록: ord-adf9d83a163a45f6b4f50222f6ded27c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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