HRID2149436

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID12677176

Ethyl 4-chloro-2-methylpyrimidine-5-carboxylate

C8H9ClN2O2

结构：CCCCNCc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID19821739

未命名化合物

PRODUCTS

生成物

结构：CCCCN(Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)c1nc(C)ncc1C(=O)OCC

HCID19791910

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-859ac57823384031a1b0fb21268cec59
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:43]([CH3:44])[O:45][C:46](=[O:47])[c:48]1[c:49]([Cl:55])[n:50][c:51]([CH3:54])[n:52][cH:53]1.[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH3:61][CH2:62][N:63]([CH2:64][CH3:65])[CH2:66][CH3:67].[c:1]1([C:7]([n:8]2[n:9][n:10][n:11][c:12]2-[c:13]2[c:14](-[c:19]3[cH:20][cH:21][c:22]([CH2:25][NH:26][CH2:27][CH2:28][CH2:29][CH3:30])[cH:23][cH:24]3)[cH:15][cH:16][cH:17][cH:18]2)([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([n:8]2[n:9][n:10][n:11][c:12]2-[c:13]2[c:14](-[c:19]3[cH:20][cH:21][c:22]([CH2:25][N:26]([CH2:27][CH2:28][CH2:29][CH3:30])[c:49]4[c:48]([C:46]([O:45][CH2:43][CH3:44])=[O:47])[cH:53][n:52][c:51]([CH3:54])[n:50]4)[cH:23][cH:24]3)[cH:15][cH:16][cH:17][cH:18]2)([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1