HRID2128908

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID31275

1,4-Dioxane

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID97478

1-(4-Chlorophenyl)piperazine

C10H13ClN2

HCID72364258

未命名化合物

PRODUCTS

产物

HCID66735675

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0e5fead5defd47cb9290c634659003a2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[Cl:19][c:20]1[cH:21][cH:22][c:23]([N:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[cH:24][cH:25]1.[Cl:1][c:2]1[n:3][c:4]([NH:11][CH:12]([C:13](=[O:14])[NH2:15])[CH:16]([CH3:17])[CH3:18])[c:5]2[c:6]([n:7]1)[CH2:8][CH2:9][S:10]2.[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1.[OH2:41]>>[c:2]1([N:29]2[CH2:28][CH2:27][N:26]([c:23]3[cH:22][cH:21][c:20]([Cl:19])[cH:25][cH:24]3)[CH2:31][CH2:30]2)[n:3][c:4]([NH:11][CH:12]([C:13](=[O:14])[NH2:15])[CH:16]([CH3:17])[CH3:18])[c:5]2[c:6]([n:7]1)[CH2:8][CH2:9][S:10]2