HRID678806

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID10797879

2-(4-(METHOXYCARBONYL)PHENYL)ACETIC ACID

C10H10O4

HCID54160428

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(CC(=O)Nc2cccc(C=Cc3nc(C4CCC4)cs3)c2)cc1

HCID54043596

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-50780f2dc5394716b1ea81b3a0729883
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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