HRID136961

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID49841002

未命名化合物

结构：COc1ccc(-n2nc(C(C)C)cc2NC(=O)Oc2ccccc2)cc1

HCID66876747

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(-n2nc(C(C)C)cc2NC(=O)Nc2cccc(Oc3ncnc4cc(OC)c(OC)cc34)c2)cc1

HCID58267745

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1da929e820da4006a08308374154e447
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([NH2:19])[cH:20][cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:54][N:55]([c:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1)[CH3:62].[CH:23]([CH3:24])([CH3:25])[c:26]1[n:27][n:28](-[c:41]2[cH:42][cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]2)[c:29]([NH:31][C:32]([O:33][c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)=[O:34])[cH:30]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([NH:19][C:32]([NH:31][c:29]4[n:28](-[c:41]5[cH:42][cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]5)[n:27][c:26]([CH:23]([CH3:24])[CH3:25])[cH:30]4)=[O:33])[cH:20][cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]