HRID2334139

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID6397

Chlorotrimethylsilane

C3H9ClSi

HCID16792107

1-(4-Aminophenyl)piperidin-4-ol

C11H16N2O

结构：Cc1ccc(S(=O)(=O)n2ccc3c(Nc4ccc5cn[nH]c5c4)nc(Cl)nc32)cc1

HCID86628035

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)n2ccc3c(Nc4ccc5cn[nH]c5c4)nc(Nc4ccc(N5CCC(O)CC5)cc4)nc32)cc1

HCID68581516

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e98aaa3f953a49019efbbc873eec901e
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

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