HRID208710

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1318

1,10-Phenanthroline

C12H8N2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID83717

Copper iodide (CuI2)

CuI2

HCID104967

Cesium(1+)

Cs+

2 次

HCID17750651

未命名化合物

HCID59843066

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(OCC(C)n3cc(-c4cccs4)ccc3=O)ccnc2c1

HCID25018640

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f42725eea89b4a01955bf9130e9e0df5
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

[C:30](=[O:31])([O-:32])[O-:33].[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[Cs+:34].[Cs+:35].[Cu:62]([I:63])[I:64].[I:17][c:18]1[cH:19][cH:20][n:21][c:22]2[cH:23][c:24]([O:28][CH3:29])[cH:25][cH:26][c:27]12.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH2:55].[OH:1][CH2:2][CH:3]([CH3:4])[n:5]1[c:6](=[O:16])[cH:7][cH:8][c:9](-[c:11]2[s:12][cH:13][cH:14][cH:15]2)[cH:10]1.[cH:36]1[cH:37][c:38]2[cH:39][cH:40][c:41]3[c:42]([c:43]2[n:44][cH:45]1)[n:46][cH:47][cH:48][cH:49]3>>[O:1]([CH2:2][CH:3]([CH3:4])[n:5]1[c:6](=[O:16])[cH:7][cH:8][c:9](-[c:11]2[s:12][cH:13][cH:14][cH:15]2)[cH:10]1)[c:18]1[cH:19][cH:20][n:21][c:22]2[cH:23][c:24]([O:28][CH3:29])[cH:25][cH:26][c:27]12