HRID2160536

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

结构：CCOC(=O)C(C(=O)OCC)=C(SCc1ccc(OC)cc1)SCc1ccc(OC)cc1

HCID11561985

未命名化合物

HCID13498003

4-Bromo-2-propylpyridine

C8H10BrN

PRODUCTS

生成物

结构：CCOC(=O)C(C(=O)OCC)C(SCc1ccc(OC)cc1)=C(CC)c1cc(Br)ccn1

HCID68689844

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-89d864fb4bf94651872211dbf9bfd080
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

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