HRID2325038

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID15547048

10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine

C12H12N2

HCID18001076

2-Methoxy-2'-methyl[1,1'-biphenyl]-4-carboxylic acid

C15H14O3

PRODUCTS

生成物

结构：COc1cc(C(=O)N2Cc3cccn3Cc3ccccc32)ccc1-c1ccccc1C

HCID68679470

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b836fb09cbd34a15a026ad6b36318ee7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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