HRID204892

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID1923

8-Hydroxyquinoline

C9H7NO

HCID19660

Carbonate

CO3-2

HCID24350

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

CuI

HCID66953

3-Morpholinone

C4H7NO2

结构：O=C(NCc1cn(-c2ccc(I)cc2)cn1)c1ccc(Cl)s1

HCID24986897

未命名化合物

PRODUCTS

生成物

结构：O=C(NCc1cn(-c2ccc(N3CCOCC3=O)cc2)cn1)c1ccc(Cl)s1

HCID16061952

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-12e45e6a1e8b4d0a918bb9e4c93c3722
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

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