HRID105705

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID643502

n-boc-4-hydroxypiperidine

C10H19NO3

结构：CN(C)CCOc1cc(S(C)(=O)=O)ccc1-n1ncc2c(Cl)ncnc21

HCID21897434

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCOc1cc(S(C)(=O)=O)ccc1-n1ncc2c(OC3CCN(C(=O)OC(C)(C)C)CC3)ncnc21

HCID53630399

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f86e07b5c9741c8a854f89847e84344
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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