HRID946159

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8018

2-Methoxyethylamine

C3H9NO

HCID81531

Diisopropylethylamine

C8H19N

结构：Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCc3ccnc(NC(=O)CCl)c3)c3ccccc23)cc1

HCID58416746

未命名化合物

PRODUCTS

生成物

结构：COCCNCC(=O)Nc1cc(COc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1

HCID45254197

N-(4-((4-(3-(3-tert-butyl-1-p-tolyl-1H-pyrazol-5-yl)ureido)naphthalen-1-yloxy)methyl)pyridin-2-yl)-2-(2-methoxyethylamino)acetamide

C36H41N7O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79ffc8a18522451b9cfcc3aeafa2b094
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7](-[c:37]2[cH:38][cH:39][c:40]([CH3:43])[cH:41][cH:42]2)[c:8]([NH:10][C:11]([NH:12][c:13]2[cH:14][cH:15][c:16]([O:23][CH2:24][c:25]3[cH:26][c:27]([NH:31][C:32]([CH2:33][Cl:34])=[O:35])[n:28][cH:29][cH:30]3)[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]23)=[O:36])[cH:9]1.[CH3:53][O:54][CH2:55][CH2:56][NH2:57].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Cl:58][CH2:59][Cl:60].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7](-[c:37]2[cH:38][cH:39][c:40]([CH3:43])[cH:41][cH:42]2)[c:8]([NH:10][C:11]([NH:12][c:13]2[cH:14][cH:15][c:16]([O:23][CH2:24][c:25]3[cH:26][c:27]([NH:31][C:32]([CH2:33][NH:57][CH2:56][CH2:55][O:54][CH3:53])=[O:35])[n:28][cH:29][cH:30]3)[c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]23)=[O:36])[cH:9]1