HRID2145338

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID6397

Chlorotrimethylsilane

C3H9ClSi

HCID7047

Quinoline

C9H7N

HCID7345

N-Acetylalanine

C5H9NO3

HCID8471

Triethylamine

C6H15N

HCID24386

Thionyl chloride

Cl2OS

HCID3281201

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NC(C)C(=O)Nc1ccc2[nH]cc(C(=O)O)c(=O)c2c1

HCID13136874

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1121761c8e484873884e6dfe46ba4b96
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH3:14][N:15]([CH3:16])[CH:17]=[O:18].[CH3:1][CH:2]([NH:3][C:4]([CH3:5])=[O:6])[C:7]([OH:8])=[O:9].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[Cl-:46].[Cl:41][Si:42]([CH3:43])([CH3:44])[CH3:45].[Cl:57][CH2:58][Cl:59].[NH2:19][c:20]1[cH:21][c:22]2[c:23](=[O:33])[c:24]([C:30](=[O:31])[OH:32])[cH:25][nH:26][c:27]2[cH:28][cH:29]1.[S:10]([Cl:11])([Cl:12])=[O:13].[cH:47]1[cH:48][c:49]2[c:50]([n:51][cH:52][cH:53][cH:54]2)[cH:55][cH:56]1>>[CH3:1][CH:2]([NH:3][C:4]([CH3:5])=[O:6])[C:7](=[O:9])[NH:19][c:20]1[cH:21][c:22]2[c:23](=[O:33])[c:24]([C:30](=[O:31])[OH:32])[cH:25][nH:26][c:27]2[cH:28][cH:29]1