HRID173943

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID15908

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

C8H17N3

HCID19188

Phenoxyacetic acid

C8H8O3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID58117006

未命名化合物

PRODUCTS

生成物

结构：Nc1ccccc1NC(=O)c1nc2c(s1)CN(C(=O)COc1ccccc1)CC2

HCID66864298

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-216ab6d83f9340ebbe0224697691ce6e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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