HRID113980

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID418932

4-[2-(DIETHYLAMINO)ETHOXY]ANILINE

C12H20N2O

结构：CN1C(=O)N(c2ccccc2Br)Cc2cnc(S(C)(=O)=O)nc21

HCID21988153

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)CCOc1ccc(Nc2ncc3c(n2)N(C)C(=O)N(c2ccccc2Br)C3)cc1

HCID21988163

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cbc4d390729744aea3603bdf45bbc764
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

[Br:1][c:2]1[c:3]([N:8]2[C:9](=[O:23])[N:10]([CH3:22])[c:11]3[n:12][c:13]([S:18]([CH3:19])(=[O:20])=[O:21])[n:14][cH:15][c:16]3[CH2:17]2)[cH:4][cH:5][cH:6][cH:7]1.[CH2:24]([CH3:25])[N:26]([CH2:27][CH2:28][O:29][c:30]1[cH:31][cH:32][c:33]([NH2:34])[cH:35][cH:36]1)[CH2:37][CH3:38]>>[Br:1][c:2]1[c:3]([N:8]2[C:9](=[O:23])[N:10]([CH3:22])[c:11]3[n:12][c:13]([NH:34][c:33]4[cH:32][cH:31][c:30]([O:29][CH2:28][CH2:27][N:26]([CH2:24][CH3:25])[CH2:37][CH3:38])[cH:36][cH:35]4)[n:14][cH:15][c:16]3[CH2:17]2)[cH:4][cH:5][cH:6][cH:7]1