HRID960946

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID31275

1,4-Dioxane

C4H8O2

HCID5013687

Methyl (4-chlorobenzene-1-sulfonyl)carbamate

C8H8ClNO4S

HCID11368884

3-(4-Chlorophenyl)-4,5-dihydro-4-phenyl-1H-pyrazole

C15H13ClN2

PRODUCTS

生成物

结构：O=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(c2ccccc2)C(c2ccc(Cl)cc2)=N1

HCID11374894

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-971625ad25374c2baec6e47d376f649f
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

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