HRID135636

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID614

DL-Proline

C5H9NO2

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID24350

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

CuI

HCID2824057

Ethyl 2-bromo-4-methylthiazole-5-carboxylate

C7H8BrNO2S

HCID67316380

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1sc(-n2ncc3c2CCC(NC(=O)OC(C)(C)C)C3)nc1C

HCID67548772

Ethyl 2-[5-[[(1,1-dimethylethoxy)carbonyl]amino]-4,5,6,7-tetrahydro-1H-indazol-1-yl]-4-methyl-5-thiazolecarboxylate

C19H26N4O4S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-136694073e364195a8c196df26252d66
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

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