HRID184511

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID70517

1-(4-Pyridyl)piperazine

C9H13N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C(O)C(c1ccccc1)n1c(=O)[nH]c2ccccc21

HCID66754578

未命名化合物

PRODUCTS

生成物

结构：O=C(C(c1ccccc1)n1c(=O)[nH]c2ccccc21)N1CCN(c2ccncc2)CC1

HCID24901169

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9eef7e5efee44c208d425ca658f8ee7a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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