HRID2152575

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID14627369

1-(Prop-2-yn-1-yl)piperazine

C7H12N2

结构：COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCBr

HCID58960242

7-(3-Bromopropoxy)-4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxyquinazoline

C21H19BrFN3O3

PRODUCTS

生成物

结构：C#CCN1CCN(CCCOc2cc3ncnc(Oc4ccc5[nH]c(C)cc5c4F)c3cc2OC)CC1

HCID10174495

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9264c6d05ce94df3bbf4c9b17ff63b3d
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

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