HRID318615

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID2759057

(4-Fluorophenoxy)acetyl chloride

C8H6ClFO2

结构：CC(C)c1ccc2c(c1)C(N1CCNCC1)Cc1ccc(F)cc1S2

HCID4125011

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1ccc2c(c1)C(N1CCN(CCOc3ccc(F)cc3)CC1)Cc1ccc(F)cc1S2

HCID4621801

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-945d2a6415534eb6afd1f9bcd4426f52
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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