HRID671149

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID27099

Copper(2+)

Cu+2

结构：CC(O[Si](C)(C)C(C)(C)C)C(C)(C)Oc1ccc(B(O)O)cc1

HCID57460958

未命名化合物

结构：CCCc1nc(CC)[nH]c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1

HCID135430564

未命名化合物

PRODUCTS

生成物

结构：CCCc1nc(CC)n(-c2ccc(OC(C)(C)C(C)O[Si](C)(C)C(C)(C)C)cc2)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1

HCID57460959

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4e3397f088064ed9ac1b4184e9a974d4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:28]([CH3:29])([CH3:30])([CH3:31])[Si:32]([O:33][CH:34]([C:35]([O:36][c:37]1[cH:38][cH:39][c:40]([B:43]([OH:44])[OH:45])[cH:41][cH:42]1)([CH3:46])[CH3:47])[CH3:48])([CH3:49])[CH3:50].[C:73]([O-:74])(=[O:75])[CH3:76].[C:78]([O-:79])(=[O:80])[CH3:81].[CH2:1]([CH3:2])[c:3]1[nH:4][c:5](=[O:27])[c:6]([CH2:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[c:20]([C:25]#[N:26])[cH:21][cH:22][cH:23][cH:24]3)[cH:17][cH:18]2)[c:7]([CH2:9][CH2:10][CH3:11])[n:8]1.[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[CH3:67][CH2:68][O:69][C:70](=[O:71])[CH3:72].[Cl:64][CH2:65][Cl:66].[Cu+2:77].[cH:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1>>[CH2:1]([CH3:2])[c:3]1[n:4](-[c:40]2[cH:39][cH:38][c:37]([O:36][C:35]([CH:34]([O:33][Si:32]([C:28]([CH3:29])([CH3:30])[CH3:31])([CH3:49])[CH3:50])[CH3:48])([CH3:46])[CH3:47])[cH:42][cH:41]2)[c:5](=[O:27])[c:6]([CH2:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[c:20]([C:25]#[N:26])[cH:21][cH:22][cH:23][cH:24]3)[cH:17][cH:18]2)[c:7]([CH2:9][CH2:10][CH3:11])[n:8]1