HRID203552

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID813

Potassium cation

K+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID32838

Diaminomethaniminium

CH6N3+

HCID4574913

未命名化合物

结构：COC(=O)c1cc(S(C)(=O)=O)c(Oc2cccc(S(F)(F)(F)(F)F)c2)cc1C

HCID11704977

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(Oc2cccc(S(F)(F)(F)(F)F)c2)c(S(C)(=O)=O)cc1C(=O)NC(=N)N

HCID178428827

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-682276d85d874e8799534a5323b7c6a1
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

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