HRID814261

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID30165

Iodide ion

I-

HCID74499

Trimethylsulfoxonium

C3H9OS+

HCID4574913

未命名化合物

结构：C=C(c1ccccc1)c1ccc2nc(-c3ccc(C4OCCCO4)cc3F)sc2n1

HCID67111819

未命名化合物

PRODUCTS

生成物

结构：Fc1cc(C2OCCCO2)ccc1-c1nc2ccc(C3(c4ccccc4)CC3)nc2s1

HCID67111466

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-83811ce2567641db99b855a8f9ae613d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[CH3:44][S:45]([CH3:46])=[O:47].[CH3:8][S+:9]([CH3:10])([CH3:11])=[O:12].[I-:7].[K+:6].[O:13]1[CH:14]([c:19]2[cH:20][c:21]([F:42])[c:22](-[c:25]3[s:26][c:27]4[n:28][c:29]([C:34](=[CH2:35])[c:36]5[cH:37][cH:38][cH:39][cH:40][cH:41]5)[cH:30][cH:31][c:32]4[n:33]3)[cH:23][cH:24]2)[O:15][CH2:16][CH2:17][CH2:18]1.[OH2:43]>>[CH2:1]1[C:34]([c:29]2[n:28][c:27]3[s:26][c:25](-[c:22]4[c:21]([F:42])[cH:20][c:19]([CH:14]5[O:13][CH2:18][CH2:17][CH2:16][O:15]5)[cH:24][cH:23]4)[n:33][c:32]3[cH:31][cH:30]2)([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[CH2:35]1