HRID146316

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID31275

1,4-Dioxane

C4H8O2

HCID11542801

未命名化合物

结构：Cc1nc(NC(N)=O)sc1-c1ccc(S(C)(=O)=O)c(F)c1

HCID57872135

未命名化合物

PRODUCTS

生成物

结构：CCc1cnc(CCNC(=O)Nc2nc(C)c(-c3ccc(S(C)(=O)=O)c(F)c3)s2)o1

HCID86598448

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4e6d4760c1b04ed0844c18f750836c65
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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