HRID196763

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID20079

Trichloroacetic anhydride

C4Cl6O3

HCID10201584

未命名化合物

HCID178519867

未命名化合物

PRODUCTS

产物

HCID178509454

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1fa70ab4a4c841688ae34a53ce6d3f6a
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

[Cl:43][C:44]([Cl:45])([Cl:46])[C:47]([O:48][C:49](=[O:50])[C:51]([Cl:52])([Cl:53])[Cl:54])=[O:55].[Cl:58][CH2:59][Cl:60].[Na+:57].[OH-:56].[OH:36][C:37]([C:38]([F:39])([F:40])[F:41])=[O:42].[c:1]1([CH2:7][CH:8]2[CH2:9][NH:10][c:11]3[c:12]([cH:23][c:24]([C:27]#[N:28])[cH:25][cH:26]3)[CH2:13][N:14]2[S:15](=[O:16])(=[O:17])[c:18]2[s:19][cH:20][cH:21][cH:22]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[nH:29]1[cH:30][n:31][c:32]([CH:34]=[O:35])[cH:33]1>>[c:1]1([CH2:7][CH:8]2[CH2:9][N:10]([CH2:34][c:32]3[n:31][cH:30][nH:29][cH:33]3)[c:11]3[c:12]([cH:23][c:24]([C:27]#[N:28])[cH:25][cH:26]3)[CH2:13][N:14]2[S:15](=[O:16])(=[O:17])[c:18]2[s:19][cH:20][cH:21][cH:22]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1