HRID171175

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID673

Glycine, N,N-dimethyl-

C4H9NO2

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID8083

Morpholine

C4H9NO

HCID19660

Carbonate

CO3-2

HCID24350

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

CuI

结构：COC(=O)c1ccc(Cl)c2c1CC(C)(C)C(c1cccc(Br)c1)N2

HCID67441269

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Cl)c2c1CC(C)(C)C(c1cccc(N3CCOCC3)c1)N2

HCID67442495

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8b37e77a5ebb458bad0715d8e2219e79
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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