HRID189538

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID8857

Ethyl Acetate

C4H8O2

HCID19660

Carbonate Ion

CO3-2

HCID2769411

未命名化合物

HCID58042302

未命名化合物

PRODUCTS

产物

HCID59436598

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f64e9996944c4c51a77c06e7c93eee62
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

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