HRID190796

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID57781260

未命名化合物

HCID57781272

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NCCC1CCc2ccc(NC(=O)CCC(C)OCc3ccccc3)c(O)c21

HCID57781273

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49dc0786ab3c436e809641190f065f6b
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

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