HRID121607

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

结构：COc1ccc(P2(=S)SP(=S)(c3ccc(OC)cc3)S2)cc1

HCID87949

p-Anisyldithiophosphonic anhydride

C14H14O2P2S4

结构：CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)C(=O)C1

HCID10891590

AG-H-15115

C16H22N2O3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)C(=S)C1

HCID19599751

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-58b53cfe12a44a83813656c21669c85f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[C:9](=[O:21])[CH2:10][N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]1.[CH3:22][O:23][c:24]1[cH:25][cH:26][c:27]([P:28]2(=[S:29])[S:30][P:32](=[S:33])([c:34]3[cH:35][cH:36][c:37]([O:38][CH3:39])[cH:40][cH:41]3)[S:31]2)[cH:42][cH:43]1.[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[C:9](=[S:31])[CH2:10][N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]1