HRID952966

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID71606

Cyclopentylacetic acid

C7H12O2

结构：COC(=O)c1ccc(Cc2cn(C)c3ccc(N)cc23)c(OC)c1

HCID11209537

Methyl 4-[(5-amino-1-methyl-1H-indol-3-yl)methyl]-3-methoxybenzoate

C19H20N2O3

PRODUCTS

生成物

结构：COC(=O)c1ccc(Cc2cn(C)c3ccc(NC(=O)CC4CCCC4)cc23)c(OC)c1

HCID14626822

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-94e79cc292e140ec851d8fc5cee12998
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

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