HRID2340243

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：CC1(Cc2ccccc2)C(=O)Nc2ccc(-c3cccc(Cl)c3)cc21

HCID21986274

未命名化合物

PRODUCTS

生成物

结构：CC1(Cc2ccccc2)C(=S)Nc2ccc(-c3cccc(Cl)c3)cc21

HCID10021648

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-971cad47150d44a68015f71ca5b58ea9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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