HRID191367

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31275

1,4-Dioxane

C4H8O2

结构：Cn1c(COc2ccc(CC3SC(=O)N(C(c4ccccc4)(c4ccccc4)c4ccccc4)C3=O)cc2)cc2ccccc21

HCID23298332

未命名化合物

PRODUCTS

生成物

结构：Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)cc2ccccc21

HCID23298328

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-416a2d3a66bd40409cefc6cd7008ecae
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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