HRID308617

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID24350

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

CuI

HCID31374

Dimethylacetamide

C4H9NO

HCID13013012

Ethyl 2-hydroxy-5-iodobenzoate

C9H9IO3

HCID19423420

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cc(C#Cc2ccc(S(=O)(=O)Nc3ncccc3C)cc2)ccc1O

HCID19423387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18752a297c584567b096baf1b6dcc97e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:14](#[CH:15])[c:16]1[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[NH:25][c:26]2[n:27][cH:28][cH:29][cH:30][c:31]2[CH3:32])[cH:20][cH:21]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][CH2:41][OH:42].[CH3:43][C:44]([N:45]([CH3:46])[CH3:47])=[O:48].[Cu:49][I:50].[OH2:51].[OH:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[cH:9][c:10]([I:13])[cH:11][cH:12]1>>[OH:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[cH:9][c:10]([C:15]#[C:14][c:16]2[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[NH:25][c:26]3[n:27][cH:28][cH:29][cH:30][c:31]3[CH3:32])[cH:20][cH:21]2)[cH:11][cH:12]1