4-(2-(Diethylamino)ethoxy)aniline → 3-(2,4-dichlorophenyl)-7-[4-[2-(diethylamino)ethoxy]anilino]-3,4-dihydro-1-methylpyrimido[4,5-d]pyrimidin-2(1H)-one

반응식

[CH2:25]([CH3:26])[N:27]([CH2:28][CH2:29][O:30][c:31]1[cH:32][cH:33][c:34]([NH2:35])[cH:36][cH:37]1)[CH2:38][CH3:39].[Cl:1][c:2]1[c:3]([N:9]2[C:10](=[O:24])[N:11]([CH3:23])[c:12]3[n:13][c:14]([S:19]([CH3:20])(=[O:21])=[O:22])[n:15][cH:16][c:17]3[CH2:18]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1>>[Cl:1][c:2]1[c:3]([N:9]2[C:10](=[O:24])[N:11]([CH3:23])[c:12]3[n:13][c:14]([NH:35][c:34]4[cH:33][cH:32][c:31]([O:30][CH2:29][CH2:28][N:27]([CH2:25][CH3:26])[CH2:38][CH3:39])[cH:37][cH:36]4)[n:15][cH:16][c:17]3[CH2:18]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

참가 물질

반응물 2

HCID 4189324-(2-(Diethylamino)ethoxy)aniline

HCID 221249993-(2,4-dichlorophenyl)-7-methanesulfonyl-3,4-dihydro-1-methylpyrimido[4,5-d]pyrimidin-2(1H)-one

생성물 1

HCID 221250663-(2,4-dichlorophenyl)-7-[4-[2-(diethylamino)ethoxy]anilino]-3,4-dihydro-1-methylpyrimido[4,5-d]pyrimidin-2(1H)-one

출처 및 근거

ORD 기록: ord-c1a51998efd44448958ba0e7d2a4d592
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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