HRID1123974

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID12473

2-Pyrrolecarboxylic acid

C5H5NO2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：CC(C)(NC(=O)c1cc2[nH]nc(NC(=O)c3ccccc3N)c2o1)c1ccccc1

HCID57878647

未命名化合物

PRODUCTS

生成物

结构：CC(C)(NC(=O)c1cc2[nH]nc(NC(=O)c3ccccc3NC(=O)c3ccc[nH]3)c2o1)c1ccccc1

HCID23624279

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a8e53099bb9544e7886c07147a59c9ca
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:54]([O:55][CH2:56][CH3:57])[CH3:58].[CH3:15][C:16]([CH3:17])([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[NH:24][C:25](=[O:26])[c:27]1[cH:28][c:29]2[nH:30][n:31][c:32]([NH:35][C:36]([c:37]3[c:38]([NH2:43])[cH:39][cH:40][cH:41][cH:42]3)=[O:44])[c:33]2[o:34]1.[Cl:51][CH2:52][Cl:53].[Cl:9][C:10]([C:11]([Cl:12])=[O:13])=[O:14].[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[cH:45]1[cH:46][cH:47][n:48][cH:49][cH:50]1.[nH:1]1[c:2]([C:6](=[O:7])[OH:8])[cH:3][cH:4][cH:5]1>>[nH:1]1[c:2]([C:6](=[O:8])[NH:43][c:38]2[c:37]([C:36]([NH:35][c:32]3[n:31][nH:30][c:29]4[cH:28][c:27]([C:25]([NH:24][C:16]([CH3:15])([CH3:17])[c:18]5[cH:19][cH:20][cH:21][cH:22][cH:23]5)=[O:26])[o:34][c:33]43)=[O:44])[cH:42][cH:41][cH:40][cH:39]2)[cH:3][cH:4][cH:5]1