HRID2157917

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6340

Ethane, iodo-

C2H5I

HCID81531

Diisopropylethylamine

C8H19N

结构：COC(=O)CC1(C)CC(c2cccc(Cl)c2)C(c2ccc(Cl)cc2)N(N)C1=O

HCID76834778

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)N1C(=O)C(C)(CC(=O)OC)CC(c2cccc(Cl)c2)C1c1ccc(Cl)cc1

HCID76834833

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3b4344e0e2448c5a93f0d7d2174d3c1
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

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