HRID1213794

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID72879

Methanesulfonamide

CH5NO2S

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

结构：CC(Oc1ncc(Oc2cc(F)c(C(=O)O)cc2Cl)cc1Cl)C(F)(F)F

HCID76671268

未命名化合物

PRODUCTS

生成物

结构：CC(Oc1ncc(Oc2cc(F)c(C(=O)NS(C)(=O)=O)cc2Cl)cc1Cl)C(F)(F)F

HCID56644213

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bc590585040d4c449d0453c2f053dec9
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

[CH3:60][S:61](=[O:62])(=[O:63])[NH2:64].[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[Cl:10][c:11]1[c:12]([O:21][c:22]2[cH:23][n:24][c:25]([O:29][CH:30]([C:31]([F:32])([F:33])[F:34])[CH3:35])[c:26]([Cl:28])[cH:27]2)[cH:13][c:14]([F:20])[c:15]([C:16](=[O:17])[OH:18])[cH:19]1.[Cl:65][CH2:66][Cl:67].[F:36][P-:37]([F:38])([F:39])([F:40])([F:41])[F:42].[n:43]1([O:44][C:45]([N:46]([CH3:47])[CH3:48])=[N+:49]([CH3:50])[CH3:51])[c:52]2[n:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1>>[Cl:10][c:11]1[c:12]([O:21][c:22]2[cH:23][n:24][c:25]([O:29][CH:30]([C:31]([F:32])([F:33])[F:34])[CH3:35])[c:26]([Cl:28])[cH:27]2)[cH:13][c:14]([F:20])[c:15]([C:16](=[O:17])[NH:64][S:61]([CH3:60])(=[O:62])=[O:63])[cH:19]1