HRID819706

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID1032

未命名化合物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7912

Diisopropylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID130500

未命名化合物

结构：Nc1nc2ccc(OS(=O)(=O)c3ccc(F)cc3)cc2s1

HCID57980814

未命名化合物

PRODUCTS

生成物

结构：CCC(=O)Nc1nc2ccc(OS(=O)(=O)c3ccc(F)cc3)cc2s1

HCID57980824

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-38920e245bd84112a8ce6bfd0f39095c
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:22][CH2:23][C:24]([OH:25])=[O:26].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[CH3:63][S:64](=[O:65])[CH3:66].[CH:51]([NH:52][CH:53]([CH3:54])[CH3:55])([CH3:56])[CH3:57].[NH2:1][c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][c:9]([O:11][S:12](=[O:13])(=[O:14])[c:15]1[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]1)[cH:10]2.[P-:27]([F:28])([F:29])([F:30])([F:31])([F:32])[F:33].[n:34]1([O:35][C:36]([N:37]([CH3:38])[CH3:39])=[N+:40]([CH3:41])[CH3:42])[c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[NH:1]([c:2]1[s:3][c:4]2[c:5]([n:6]1)[cH:7][cH:8][c:9]([O:11][S:12](=[O:13])(=[O:14])[c:15]1[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]1)[cH:10]2)[C:24]([CH2:23][CH3:22])=[O:25]