HRID825633

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

2 次

HCID23938

Palladium

HCID31275

1,4-Dioxane

C4H8O2

HCID761929

5-bromo-1H-indazole

C7H5BrN2

结构：CC1(C)OB(c2ccc3cc(NC(=O)c4ccsc4)ccc3c2)OC1(C)C

HCID67386422

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccc2cc(-c3ccc4[nH]ncc4c3)ccc2c1)c1ccsc1

HCID58828843

N-[6-(1H-Indazol-5-yl)naphthalen-2-yl]thiophene-3-carboxamide

C22H15N3OS

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f60c40b625344d1793f01bf2187a0a1a
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]2[cH:5][n:6][nH:7][c:8]2[cH:9][cH:10]1.[C:44](=[O:45])([O-:46])[O-:47].[CH2:52]([Cl:53])[Cl:54].[CH2:55]1[O:56][CH2:57][CH2:58][O:59][CH2:60]1.[CH3:11][C:12]1([CH3:13])[C:14]([CH3:15])([CH3:16])[O:17][B:18]([c:19]2[cH:20][c:21]3[cH:22][cH:23][c:24]([NH:29][C:30](=[O:31])[c:32]4[cH:33][s:34][cH:35][cH:36]4)[cH:25][c:26]3[cH:27][cH:28]2)[O:37]1.[K+:38].[K+:39].[Na+:48].[Na+:49].[O-:40][C:41]([O-:42])=[O:43].[OH2:51].[Pd:50]>>[c:2]1(-[c:19]2[cH:20][c:21]3[cH:22][cH:23][c:24]([NH:29][C:30](=[O:31])[c:32]4[cH:33][s:34][cH:35][cH:36]4)[cH:25][c:26]3[cH:27][cH:28]2)[cH:3][c:4]2[cH:5][n:6][nH:7][c:8]2[cH:9][cH:10]1