HRID1220213

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID18179616

1-Benzyl-2-oxo-1,2-dihydropyridine-4-carboxylic acid

C13H11NO3

结构：NCc1c(-c2ncco2)n(-c2ccccc2)c2ncccc2c1=O

HCID71208505

未命名化合物

PRODUCTS

生成物

结构：O=C(NCc1c(-c2ncco2)n(-c2ccccc2)c2ncccc2c1=O)c1ccn(Cc2ccccc2)c(=O)c1

HCID71217332

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5324ec0fc6aa4ad38cbe7226e439a357
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

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