HRID823724

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID76777

Dimethylphosphinic acid

C2H7O2P

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(C)(C)OC(=O)Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(CO)cc1

HCID57607813

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(COP(C)(C)=O)cc1

HCID57925914

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-80e751f53d724b428a3f921a83a7500a
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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