HRID804117

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

HCID166653

Hydride

H-

结构：Cc1nc2c(OCc3ccccc3)cc(C(=O)N(C)C)cc2[nH]1

HCID68574634

N,N,2-Trimethyl-7-(phenylmethoxy)-1H-benzimidazole-5-carboxamide

C18H19N3O2

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)n2c(C)nc3c(OCc4ccccc4)cc(C(=O)N(C)C)cc32)cc1

HCID67220174

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4edb8cb767124d299d2a018aee2003a6
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

[CH3:1][N:2]([C:3](=[O:4])[c:5]1[cH:6][c:7]([O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:8]2[c:9]([nH:10][c:11]([CH3:13])[n:12]2)[cH:14]1)[CH3:23].[CH3:26][c:27]1[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[Cl:36])[cH:31][cH:32]1.[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[H-:24].[Na+:25].[OH2:37]>>[CH3:1][N:2]([C:3](=[O:4])[c:5]1[cH:6][c:7]([O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:8]2[c:9]([n:10]([S:33]([c:30]3[cH:29][cH:28][c:27]([CH3:26])[cH:32][cH:31]3)(=[O:34])=[O:35])[c:11]([CH3:13])[n:12]2)[cH:14]1)[CH3:23]