HRID113816

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID1049

Pyridine

C5H5N

HCID1140

Toluene

C7H8

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID82408

Isopropyl sulfonyl chloride

C3H7ClO2S

HCID135520

3,4-Diaminobenzophenone

C13H12N2O

PRODUCTS

生成物

结构：CC(C)S(=O)(=O)Nc1cc(C(=O)c2ccccc2)ccc1N

HCID13363149

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c670810b7bbf4ab09dc12172ecb6b9f3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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