HRID691221

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31275

1,4-Dioxane

C4H8O2

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

HCID87949

p-Anisyldithiophosphonic anhydride

C14H14O2P2S4

结构：O=C1NC(=O)C2(CC(c3ccccc3)Oc3ccc(Br)cc32)N1

HCID58423847

未命名化合物

PRODUCTS

生成物

结构：O=C1NC(=S)NC12CC(c1ccccc1)Oc1ccc(Br)cc12

HCID58423943

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6062c000556f4083a5b1a46389d192a8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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