HRID139678

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

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

HCID87949

p-Anisyldithiophosphonic anhydride

C14H14O2P2S4

反应SMILES：CC(C)Oc1ccc(F)c(F)c1C1NC(=O)CC(c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

HCID74370373

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)Oc1ccc(F)c(F)c1C1NC(=S)CC(c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

HCID74370615

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-cb75f556007f49d6a46471dce46aea37
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

[CH3:37][O:38][c:39]1[cH:40][cH:41][c:42]([P:43]2(=[S:44])[S:45][P:47](=[S:48])([c:49]3[cH:50][cH:51][c:52]([O:53][CH3:54])[cH:55][cH:56]3)[S:46]2)[cH:57][cH:58]1.[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[C:6]21[CH:12]([c:25]2[c:26]([F:36])[c:27]([F:35])[cH:28][cH:29][c:30]2[O:31][CH:32]([CH3:33])[CH3:34])[NH:13][C:14](=[O:24])[CH2:15][CH:16]1[c:17]1[cH:18][c:19]([Cl:23])[cH:20][cH:21][cH:22]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[C:6]21[CH:12]([c:25]2[c:26]([F:36])[c:27]([F:35])[cH:28][cH:29][c:30]2[O:31][CH:32]([CH3:33])[CH3:34])[NH:13][C:14](=[S:46])[CH2:15][CH:16]1[c:17]1[cH:18][c:19]([Cl:23])[cH:20][cH:21][cH:22]1