HRID691036

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID19660

Carbonate

CO3-2

HCID92342

Pyridine, 2-chloro-5-(trifluoromethyl)-

C6H3ClF3N

HCID13309629

2-(Benzylsulfanyl)ethyl 2-(4-hydroxyphenoxy)propanoate

C18H20O4S

PRODUCTS

生成物

结构：CC(Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)OCCSCc1ccccc1

HCID13309473

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-220537d94a15461cafe34f698602d165
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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