HRID1553912

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID5943

Carbon tetrachloride

CCl4

HCID6342

Acetonitrile

C2H3N

HCID11776

Triphenylphosphine

C18H15P

结构：CC(=Cc1ccc(S(=O)(=O)CCO)cc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

HCID54045323

未命名化合物

PRODUCTS

生成物

结构：CC(=Cc1ccc(S(=O)(=O)CCCl)cc1)c1ccc2c(c1)C(C)(C)CCC2(C)C

HCID69982303

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a5d084651e0a46c0ad024dfd2ad90aed
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:49]([Cl:50])([Cl:51])([Cl:52])[Cl:53].[CH3:1][C:2]1([CH3:29])[c:3]2[cH:4][cH:5][c:6]([C:14](=[CH:15][c:16]3[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[CH2:25][CH2:26][OH:27])[cH:20][cH:21]3)[CH3:28])[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1.[CH3:55][C:56]#[N:57].[OH2:54].[c:30]1([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[CH3:1][C:2]1([CH3:29])[c:3]2[cH:4][cH:5][c:6]([C:14](=[CH:15][c:16]3[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[CH2:25][CH2:26][Cl:50])[cH:20][cH:21]3)[CH3:28])[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1