HRID2156698

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11776

Triphenylphosphine

C18H15P

HCID10754583

未命名化合物

HCID14357405

未命名化合物

HCID16216917

(2,4-Diethoxyphenyl)methanol

C11H16O3

PRODUCTS

生成物

结构：CCOc1ccc(CN2C(=O)SC(S(=O)(=O)c3ccc(C)cc3)C2=O)c(OCC)c1

HCID22678099

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-41a3f52016844c32ab8b81f961ee8fb9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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