HRID959277

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID31275

1,4-Dioxane

C4H8O2

HCID2756810

tert-Butyl 3-methylpiperazine-1-carboxylate

C10H20N2O2

HCID4574913

未命名化合物

结构：Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(Cl)nc3)cc3c2c(C)cn3C(C)C)c(=O)[nH]1

HCID86677349

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(N4CCN(C(=O)OC(C)(C)C)CC4C)nc3)cc3c2c(C)cn3C(C)C)c(=O)[nH]1

HCID71269601

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8c201c1f51924660b1bb51fa73ef6381
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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