HRID2122662

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID90495

Di-tert-butyl dicarbonate

C10H18O5

HCID762654

1-Benzoylpiperazine

C11H14N2O

HCID15176238

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1(C(=O)OCc2ccccc2)CCCCC1)N1CCN(C(=O)c2ccccc2)CC1

HCID57672916

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3846fc5fdf144e578a4166e2f48feb75
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

[C:18](=[O:19])([O:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32].[C:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)(=[O:47])[N:48]1[CH2:49][CH2:50][NH:51][CH2:52][CH2:53]1.[CH2:54]([Cl:55])[Cl:56].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[c:1]1([CH2:7][O:8][C:9](=[O:10])[C:11]2([NH2:17])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][O:8][C:9](=[O:10])[C:11]2([NH:17][C:18](=[O:19])[N:51]3[CH2:50][CH2:49][N:48]([C:40]([c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)=[O:47])[CH2:53][CH2:52]3)[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1