HRID98881

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID614

DL-Proline

C5H9NO2

HCID679

Dimethyl sulfoxide

C2H6OS

HCID923

Sodium ion

Na+

HCID24350

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

CuI

HCID3870744

Methanesulfinate

CH3O2S-

结构：O=C1N(Cc2ccc(Br)o2)c2ccccc2C12COc1cc3c(cc12)OCO3

HCID59263437

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1ccc(CN2C(=O)C3(COc4cc5c(cc43)OCO5)c3ccccc32)o1

HCID59263418

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc804306f41f4b35a991a343343722a0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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