HRID1232312

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID12902598

2-Methylpyridine-3-carbonyl chloride

C7H6ClNO

反应SMILES：Cc1ccc2cccc(OCc3c(Cl)ccc(-n4cccc4CNC(=O)C=Cc4ccc(N)nc4)c3Cl)c2n1

HCID53950894

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1ccc2cccc(OCc3c(Cl)ccc(-n4cccc4CNC(=O)C=Cc4ccc(NC(=O)c5cccnc5C)nc4)c3Cl)c2n1

HCID54549920

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f6cf9bbdea1c4522877bc812d3b49a5a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

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