HRID1237563

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID182769

Benzoic acid, 3-((dipropylamino)carbonyl)-

C14H19NO3

结构：CC(C)CNC(=O)C(NC(=O)C(C)NCC(N)Cc1ccccc1)C(C)C

HCID178449522

未命名化合物

PRODUCTS

生成物

结构：CCCN(CCC)C(=O)c1cccc(C(=O)NC(CNC(C)C(=O)NC(C(=O)NCC(C)C)C(C)C)Cc2ccccc2)c1

HCID23400426

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e991a89bb824c178df801b72ee5df7c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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