HRID2316903

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID66174

2-Amino-5-chloropyridine

C5H5ClN2

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(Cl)cn1)(c1ccccc1)c1ccccc1

HCID178455536

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a0c48f64578d4d929f6ce7a4f6e0760f
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:13]([CH3:14])([CH3:15])([CH3:16])[Si:17]([O:18][CH2:19][CH2:20][O:21][CH2:22][CH:23]([C:24](=[O:25])[O:26][CH3:27])[O:28][c:29]1[c:30]2[c:31]([n:32][cH:33][n:34]1)[n:35](-[c:38]1[c:39]([Cl:45])[c:40]([Cl:44])[cH:41][cH:42][cH:43]1)[n:36][cH:37]2)([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)[c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[Cl:5][c:6]1[cH:7][cH:8][c:9]([NH2:12])[n:10][cH:11]1>>[Cl:5][c:6]1[cH:7][cH:8][c:9]([NH:12][C:24]([CH:23]([CH2:22][O:21][CH2:20][CH2:19][O:18][Si:17]([C:13]([CH3:14])([CH3:15])[CH3:16])([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[O:28][c:29]2[c:30]3[c:31]([n:32][cH:33][n:34]2)[n:35](-[c:38]2[c:39]([Cl:45])[c:40]([Cl:44])[cH:41][cH:42][cH:43]2)[n:36][cH:37]3)=[O:25])[n:10][cH:11]1