HRID201473

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID13837325

Oxolan-3-yl 4-methylbenzene-1-sulfonate

C11H14O4S

结构：Cn1ccc(NC(=O)c2cc(O)cc(OCc3ccccc3)c2)n1

HCID59127119

3-(Benzyloxy)-5-hydroxy-N-(1-methyl-1H-pyrazol-3-yl)benzamide

C18H17N3O3

PRODUCTS

生成物

结构：Cn1ccc(NC(=O)c2cc(OCc3ccccc3)cc(OC3CCOC3)c2)n1

HCID67027454

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-34d34b88701b4792b869b6d5e6be328d
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:41](=[O:42])([O-:43])[O-:44].[CH3:25][c:26]1[cH:27][cH:28][c:29]([S:30]([O:31][CH:36]2[CH2:37][O:38][CH2:39][CH2:40]2)(=[O:32])=[O:33])[cH:34][cH:35]1.[CH3:47][C:48]#[N:49].[K+:45].[K+:46].[OH:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[n:9][n:10]([CH3:13])[cH:11][cH:12]2)[cH:14][c:15]([O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:16]1>>[O:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[n:9][n:10]([CH3:13])[cH:11][cH:12]2)[cH:14][c:15]([O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:16]1)[CH:36]1[CH2:37][O:38][CH2:39][CH2:40]1