HRID941408

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID80972

Ethane, 1-bromo-2-methoxy-

C3H7BrO

HCID166653

Hydride

H-

结构：CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(Nc3nc(-c4ccc5cc(O)ccc5c4)cc4ccnn34)cc2)cc1

HCID136388310

未命名化合物

PRODUCTS

生成物

结构：COCCOc1ccc2cc(-c3cc4ccnn4c(Nc4ccc(NC(=O)c5ccc(CNC(=O)OC(C)(C)C)cc5)cc4)n3)ccc2c1

HCID67318656

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-da9a2428cc834a3fa8c823272a1ec7a6
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

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