HRID91996

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID2769364

4-Chloro-6,7-dimethoxyquinazoline

C10H9ClN2O2

HCID3280088

未命名化合物

HCID68880158

未命名化合物

PRODUCTS

生成物

结构：COc1cc2ncnc(Nc3c(Cl)cc(C#CC(C)OC)c4c3OCO4)c2cc1OC

HCID68880608

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df54807537ee474ca2f9e83a148b4526
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:1][Si:2]([N-:3][Si:4]([CH3:5])([CH3:6])[CH3:7])([CH3:8])[CH3:9].[Cl-:53].[Cl:16][c:17]1[c:18]([NH2:32])[c:19]2[c:20]([c:24]([C:26]#[C:27][CH:28]([CH3:29])[O:30][CH3:31])[cH:25]1)[O:21][CH2:22][O:23]2.[Cl:33][c:34]1[n:35][cH:36][n:37][c:38]2[cH:39][c:40]([O:46][CH3:47])[c:41]([O:44][CH3:45])[cH:42][c:43]12.[NH4+:54].[Na+:10].[O:11]1[CH2:12][CH2:13][CH2:14][CH2:15]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[Cl:16][c:17]1[c:18]([NH:32][c:34]2[n:35][cH:36][n:37][c:38]3[cH:39][c:40]([O:46][CH3:47])[c:41]([O:44][CH3:45])[cH:42][c:43]23)[c:19]2[c:20]([c:24]([C:26]#[C:27][CH:28]([CH3:29])[O:30][CH3:31])[cH:25]1)[O:21][CH2:22][O:23]2