HRID957161

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8150

Diethylene glycol dimethyl ether

C6H14O3

HCID418932

4-[2-(DIETHYLAMINO)ETHOXY]ANILINE

C12H20N2O

结构：CSc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1

HCID10736701

6-(2,6-Dichlorophenyl)-8-methyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one

C15H11Cl2N3OS

PRODUCTS

生成物

结构：CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1

HCID5311382

6-(2,6-Dichlorophenyl)-2-[4-[2-(diethylamino)ethoxy]anilino]-8-methylpyrido[2,3-d]pyrimidin-7-one

C26H27Cl2N5O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-47d46f82168d47fe9091f9b2a718cbdd
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:23]([CH3:24])[N:25]([CH2:26][CH2:27][O:28][c:29]1[cH:30][cH:31][c:32]([NH2:33])[cH:34][cH:35]1)[CH2:36][CH3:37].[CH3:38][O:39][CH2:40][CH2:41][O:42][CH2:43][CH2:44][O:45][CH3:46].[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([S:17][CH3:18])[n:15][cH:16]3)[n:19]([CH3:22])[c:20]2=[O:21])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[OH2:47]>>[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([NH:33][c:32]4[cH:31][cH:30][c:29]([O:28][CH2:27][CH2:26][N:25]([CH2:23][CH3:24])[CH2:36][CH3:37])[cH:35][cH:34]4)[n:15][cH:16]3)[n:19]([CH3:22])[c:20]2=[O:21])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1