HRID937453

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID9274

O,O′-Diethyl hydrogen dithiophosphate

C4H11O2PS2

HCID81531

Diisopropylethylamine

C8H19N

HCID17819761

Trioxide, dimethyl

C2H6O3

结构：CC(C)n1cc(-c2ccc(C#N)c(F)c2)c2ccc(NS(C)(=O)=O)cc21

HCID51346768

未命名化合物

PRODUCTS

生成物

结构：CC(C)n1cc(-c2ccc(C(N)=S)c(F)c2)c2ccc(NS(C)(=O)=O)cc21

HCID57442258

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b16e24ccf3ba44faa8c69ca4995c04c3
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:11](#[N:12])[c:13]1[c:14]([F:36])[cH:15][c:16](-[c:19]2[cH:20][n:21]([CH:33]([CH3:34])[CH3:35])[c:22]3[cH:23][c:24]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:25][cH:26][c:27]23)[cH:17][cH:18]1.[CH2:37]([O:38][P:39](=[S:40])([SH:41])[O:42][CH2:43][CH3:44])[CH3:45].[CH3:46][O:47][O:48][O:49][CH3:50].[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[OH2:10]>>[C:11]([NH2:12])([c:13]1[c:14]([F:36])[cH:15][c:16](-[c:19]2[cH:20][n:21]([CH:33]([CH3:34])[CH3:35])[c:22]3[cH:23][c:24]([NH:28][S:29](=[O:30])(=[O:31])[CH3:32])[cH:25][cH:26][c:27]23)[cH:17][cH:18]1)=[S:41]