HRID150672

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID31275

1,4-Dioxane

C4H8O2

HCID16682925

Aluminum, trimethyl-

C3H9Al

HCID50878390

2-Phenylimidazo[1,2-a]pyrimidin-7-amine

C12H10N4

HCID58368056

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccn2cc(-c3ccccc3)nc2n1)c1nc(C2CC2)ccc1Nc1cncnc1

HCID53468024

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bb44cad27d4a4300aa4b6a74dffab88c
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

[CH2:21]([O:23][C:24](=[O:22])[c:26]1[n:27][c:28]([CH:39]2[CH2:40][CH2:41]2)[cH:29][cH:30][c:31]1[NH:32][c:33]1[cH:34][n:35][cH:36][n:37][cH:38]1)[CH3:25].[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:52][OH:53].[Cl:49][CH2:50][Cl:51].[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[OH2:42].[c:5]1(-[c:11]2[n:12][c:13]3[n:14]([cH:15][cH:16][c:17]([NH2:19])[n:18]3)[cH:20]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[c:5]1(-[c:11]2[n:12][c:13]3[n:14]([cH:15][cH:16][c:17]([NH:19][C:24](=[O:23])[c:26]4[n:27][c:28]([CH:39]5[CH2:40][CH2:41]5)[cH:29][cH:30][c:31]4[NH:32][c:33]4[cH:34][n:35][cH:36][n:37][cH:38]4)[n:18]3)[cH:20]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1