HRID1210874

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID1174

Uracil

C4H4N2O2

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl acetate

C4H8O2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID24700711

N-(2-Cyanophenyl)pyridine-2-carboxamide

C13H9N3O

HCID57419440

1,5-Diiodo-2-methoxy-3-(2-methyl-2-propanyl)benzene

C11H14I2O

PRODUCTS

生成物

结构：COc1c(I)cc(-n2ccc(=O)[nH]c2=O)cc1C(C)(C)C

HCID57493877

1-(3-tert-Butyl-5-iodo-4-methoxyphenyl)pyrimidine-2,4(1H,3H)-dione

C15H17IN2O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2c66cfada3974f9ca7314ca7e0bc845c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][c:23]1[NH:24][C:25](=[O:26])[c:27]1[n:28][cH:29][cH:30][cH:31][cH:32]1)#[N:33].[C:34]([CH3:35])([CH3:36])([CH3:37])[c:38]1[c:39]([O:46][CH3:47])[c:40]([I:45])[cH:41][c:42]([I:44])[cH:43]1.[CH3:48][S:49]([CH3:50])=[O:51].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[CH3:60][C:61]#[N:62].[Cu:58][I:59].[K+:14].[K+:15].[K+:16].[P:9]([O-:10])([O-:11])([O-:12])=[O:13].[nH:1]1[c:2](=[O:3])[nH:4][c:5](=[O:6])[cH:7][cH:8]1>>[n:1]1(-[c:42]2[cH:41][c:40]([I:45])[c:39]([O:46][CH3:47])[c:38]([C:34]([CH3:35])([CH3:36])[CH3:37])[cH:43]2)[c:2](=[O:3])[nH:4][c:5](=[O:6])[cH:7][cH:8]1