2,4,6-Trimethylaniline → 6-(3,4-Dimethoxyphenyl)-2-methyl-4-(2,4,6-trimethylphenylamino)pyrimidine

반응식

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

참가 물질

반응물 3

HCID 69132,4,6-Trimethylaniline

HCID 8857Ethyl Acetate

HCID 201522714-Chloro-6-(3,4-dimethoxyphenyl)-2-methylpyrimidine

생성물 1

HCID 201522766-(3,4-Dimethoxyphenyl)-2-methyl-4-(2,4,6-trimethylphenylamino)pyrimidine

출처 및 근거

ORD 기록: ord-e6e70363bb5841759dea8720442c3712
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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