HRID2313364

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID818260

2-Amino-5-cyanopyridine

C6H5N3

HCID16682925

Aluminum, trimethyl-

C3H9Al

结构：COC(=O)C(COCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)Oc1ncnc2c1cnn2-c1cccc(Cl)c1Cl

HCID57504549

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)[Si](OCCOCC(Oc1ncnc2c1cnn2-c1cccc(Cl)c1Cl)C(=O)Nc1ccc(C#N)cn1)(c1ccccc1)c1ccccc1

HCID178455537

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f351723e4e0b468189c586994b617a3b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:14]([CH3:15])([CH3:16])([CH3:17])[Si:18]([O:19][CH2:20][CH2:21][O:22][CH2:23][CH:24]([C:25](=[O:26])[O:27][CH3:28])[O:29][c:30]1[c:31]2[c:32]([n:33][cH:34][n:35]1)[n:36](-[c:39]1[c:40]([Cl:46])[c:41]([Cl:45])[cH:42][cH:43][cH:44]1)[n:37][cH:38]2)([c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1)[c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[NH2:5][c:6]1[n:7][cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1>>[NH:5]([c:6]1[n:7][cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1)[C:25]([CH:24]([CH2:23][O:22][CH2:21][CH2:20][O:19][Si:18]([C:14]([CH3:15])([CH3:16])[CH3:17])([c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1)[c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1)[O:29][c:30]1[c:31]2[c:32]([n:33][cH:34][n:35]1)[n:36](-[c:39]1[c:40]([Cl:46])[c:41]([Cl:45])[cH:42][cH:43][cH:44]1)[n:37][cH:38]2)=[O:26]