HRID1233299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：COc1ccc(C(Nc2cc(F)cc3[nH]c(=O)ccc23)C2(C(F)(F)F)CO2)c(Cl)c1F

HCID46222190

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(Nc2cc(F)cc3[nH]c(=O)ccc23)C(O)(CO)C(F)(F)F)c(Cl)c1F

HCID42623263

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-da0a99a5ffb644c98a8f61895243ea0e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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