HRID95316

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID796563

1-(4-Fluorobenzyl)piperazine

C11H15FN2

HCID67359013

未命名化合物

PRODUCTS

生成物

结构：O=C(CN1CCC(c2ccccc2)(c2ccccc2)C1=O)N1CCN(Cc2ccc(F)cc2)CC1

HCID57403781

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-14445660dd994dab9f9f17f975430861
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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