HRID1137509

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID70372

3,4,5-Trimethoxyphenylacetic acid

C11H14O5

结构：Cc1onc2c1c(=O)n(C1C=CC(N)C1)c1cccc(Cl)c21

HCID12094964

未命名化合物

PRODUCTS

生成物

结构：COc1cc(CC(=O)NC2C=CC(n3c(=O)c4c(C)onc4c4c(Cl)cccc43)C2)cc(OC)c1OC

HCID22714093

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-51d4c9a2dcd742929df9f1441a379ef9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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