HRID2349924

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8082

Piperidine

C5H11N

HCID81531

Diisopropylethylamine

C8H19N

结构：CC1CN(Cc2ccc(NS(=O)(=O)c3ccc(Cl)nc3)cc2)CCN1C(=O)OC(C)(C)C

HCID178430378

未命名化合物

PRODUCTS

生成物

结构：CC1CN(Cc2ccc(NS(=O)(=O)c3ccc(N4CCCCC4)nc3)cc2)CCN1C(=O)OC(C)(C)C

HCID178430380

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7ae129f7d3be461f942f5dba88962b8e
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

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