HRID1232828

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID4574913

未命名化合物

HCID21906090

tert-Butyl 4-sulfanylpiperidine-1-carboxylate

C10H19NO2S

HCID57954388

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(SCc2nc(-c3ccncc3)no2)CC1

HCID57954409

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5e1875c5d5f141be94db767fb0c378ed
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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