4-Amino-3-chloro-5-methylbenzonitrile → 2-Ethyl-7-methoxyfuro[2,3-c]pyridine-4-carboxylic acid (2-chloro-4-cyano-6-methylphenyl)amide

반응식

[N+:1]([c:2]1[cH:3][cH:4][c:5]([O:6][C:11](=[O:12])[c:13]2[c:14]3[c:15]([c:16]([O:19][CH3:20])[n:17][cH:18]2)[o:21][c:22]([CH2:24][CH3:25])[cH:23]3)[cH:7][cH:8]1)([O-:9])=[O:10].[NH2:26][c:27]1[c:28]([Cl:36])[cH:29][c:30]([C:31]#[N:32])[cH:33][c:34]1[CH3:35]>>[C:11](=[O:12])([c:13]1[c:14]2[c:15]([c:16]([O:19][CH3:20])[n:17][cH:18]1)[o:21][c:22]([CH2:24][CH3:25])[cH:23]2)[NH:26][c:27]1[c:28]([Cl:36])[cH:29][c:30]([C:31]#[N:32])[cH:33][c:34]1[CH3:35]

참가 물질

반응물 2

HCID 27353014-Amino-3-chloro-5-methylbenzonitrile

HCID 541193452-Ethyl-7-methoxyfuro[2,3-c]pyridine-4-carboxylic acid 4-nitrophenyl ester

생성물 1

HCID 443653432-Ethyl-7-methoxyfuro[2,3-c]pyridine-4-carboxylic acid (2-chloro-4-cyano-6-methylphenyl)amide

출처 및 근거

ORD 기록: ord-b3d371cc5744412cbc2749fa3e684a7b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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