HRID1116393

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID2155

2-Aminothiazole

C3H4N2S

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：O=C(O)C(Oc1ccc(F)cc1F)c1ccc(S(=O)(=O)C2CC2)cc1

HCID59610032

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1nccs1)C(Oc1ccc(F)cc1F)c1ccc(S(=O)(=O)C2CC2)cc1

HCID25261986

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-85062bff2b48456e82d559c8809c21a6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH:1]1([S:4](=[O:5])(=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH:13]([C:14](=[O:15])[OH:16])[O:17][c:18]3[c:19]([F:25])[cH:20][c:21]([F:24])[cH:22][cH:23]3)[cH:11][cH:12]2)[CH2:2][CH2:3]1.[Cl:26][C:27]([C:28]([Cl:29])=[O:30])=[O:31].[Cl:39][CH2:40][Cl:41].[ClH:38].[NH2:32][c:33]1[s:34][cH:35][cH:36][n:37]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[CH:1]1([S:4](=[O:5])(=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH:13]([C:14](=[O:15])[NH:32][c:33]3[s:34][cH:35][cH:36][n:37]3)[O:17][c:18]3[c:19]([F:25])[cH:20][c:21]([F:24])[cH:22][cH:23]3)[cH:11][cH:12]2)[CH2:2][CH2:3]1