HRID1563465

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID15290319

3-Chloro-1H-indole-2-carboxylic acid

C9H6ClNO2

HCID59473728

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Cn1ccc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cc21

HCID59473712

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca86daa17f064deca68140ba1e5f8f9b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:10][CH2:11][N:12]=[C:13]=[N:14][CH2:15][CH2:16][CH2:17][N:18]([CH3:19])[CH3:20].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[Cl:31][c:32]1[c:33]([C:41](=[O:42])[OH:43])[nH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12.[Cl:67][CH2:68][Cl:69].[NH2:44][c:45]1[cH:46][cH:47][c:48]2[cH:49][cH:50][n:51]([CH2:54][C:55](=[O:56])[O:57][C:58]([CH3:59])([CH3:60])[CH3:61])[c:52]2[cH:53]1.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH:21][n:22]1[c:23]2[c:24]([cH:25][cH:26][cH:27][cH:28]2)[n:29][n:30]1>>[Cl:31][c:32]1[c:33]([C:41](=[O:43])[NH:44][c:45]2[cH:46][cH:47][c:48]3[cH:49][cH:50][n:51]([CH2:54][C:55](=[O:56])[O:57][C:58]([CH3:59])([CH3:60])[CH3:61])[c:52]3[cH:53]2)[nH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12