HRID176109

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID7914

Isopropyl ether

C6H14O

HCID85247

Silane, iodotrimethyl-

C3H9ISi

结构：COc1cc2c(-c3cc4cccnc4n3S(=O)(=O)c3ccc(C)cc3)c[nH]c2cc1OCc1ccccc1

HCID22477397

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(-c3cc4cccnc4n3S(=O)(=O)c3ccc(C)cc3)c[nH]c2cc1O

HCID67147580

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b2b19c08d3144802aeba25ae5018d03f
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

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:37][CH3:38])[cH:11][c:12]2[c:13](-[c:18]3[cH:19][c:20]4[c:21]([n:22][cH:23][cH:24][cH:25]4)[n:26]3[S:27](=[O:28])(=[O:29])[c:30]3[cH:31][cH:32][c:33]([CH3:36])[cH:34][cH:35]3)[cH:14][nH:15][c:16]2[cH:17]1.[CH3:39][Si:40]([I:41])([CH3:42])[CH3:43].[CH3:44][C:45]#[N:46].[CH:47]([O:48][CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53]>>[OH:8][c:9]1[c:10]([O:37][CH3:38])[cH:11][c:12]2[c:13](-[c:18]3[cH:19][c:20]4[c:21]([n:22][cH:23][cH:24][cH:25]4)[n:26]3[S:27](=[O:28])(=[O:29])[c:30]3[cH:31][cH:32][c:33]([CH3:36])[cH:34][cH:35]3)[cH:14][nH:15][c:16]2[cH:17]1