HRID194512

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID202185

1,3,4-Oxadiazole, 2-amino-5-(2-furyl)-

C6H5N3O2

HCID67204864

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3nnc(-c4ccco4)o3)c2c1

HCID67205442

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-776208a3d55c43b28833bb83f47b19ec
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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