3,4,5-Trimethoxyaniline → N2-(3,4,5-Trimethoxyphenyl)-N4-(5-phenylisoxazol-3-yl)-2,4-pyrimidinediamine

반응식

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

참가 물질

반응물 2

HCID 322853,4,5-Trimethoxyaniline

HCID 219364562-chloro-N4-(5-phenylisoxazol-3-yl)-4-pyrimidineamine

생성물 1

HCID 21060794N2-(3,4,5-Trimethoxyphenyl)-N4-(5-phenylisoxazol-3-yl)-2,4-pyrimidinediamine

출처 및 근거

ORD 기록: ord-422c3161615c4d7690225b7056290208
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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