HRID211821

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7369

Benzenesulfonyl chloride

C6H5ClO2S

HCID8471

Triethylamine

C6H15N

HCID15291362

未命名化合物

PRODUCTS

生成物

结构：O=c1[nH]c2c(n3ccnc13)C(NS(=O)(=O)c1ccccc1)c1ccccc1-2

HCID18918196

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b516aca42f15497ab7e20cac96c2f72c
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

[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[CH3:43][C:44](=[O:45])[OH:46].[ClH:1].[NH2:2][CH:3]1[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2-[c:10]2[nH:11][c:12](=[O:19])[c:13]3[n:14]([c:15]21)[cH:16][cH:17][n:18]3.[OH2:37].[c:20]1([S:26](=[O:27])(=[O:28])[Cl:29])[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[NH:2]([CH:3]1[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2-[c:10]2[nH:11][c:12](=[O:19])[c:13]3[n:14]([c:15]21)[cH:16][cH:17][n:18]3)[S:26]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)(=[O:27])=[O:28]