HRID214620

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID20695

4-Hydroxypyrimidine

C4H4N2O

HCID23978

Copper

HCID24350

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

CuI

HCID551074

N,N'-Dimethyl-1,2-cyclohexanediamine

C8H18N2

HCID66906121

未命名化合物

PRODUCTS

生成物

结构：O=c1ccncn1-c1ccc2nc(N3CCC(N4CCCCC4)C3)sc2c1

HCID66905565

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dce4bc3e238f44fa9954c4c3d83edc31
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

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