HRID1138583

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID53229355

未命名化合物

HCID57930198

{1-[3-(Propan-2-yl)-1,2,4-oxadiazol-5-yl]piperidin-4-yl}methyl methanesulfonate

C12H21N3O4S

PRODUCTS

生成物

结构：CSc1ccc(-c2ccc(OCC3CCN(c4nc(C(C)C)no4)CC3)cn2)cc1

HCID66673623

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b852a6c8a7649a48883d49f6a832743
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:16][S:17]([O:18][CH2:21][CH:22]1[CH2:23][CH2:24][N:25]([c:28]2[n:29][c:30]([CH:33]([CH3:34])[CH3:35])[n:31][o:32]2)[CH2:26][CH2:27]1)(=[O:19])=[O:20].[CH3:1][S:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([OH:15])[cH:13][n:14]2)[cH:7][cH:8]1.[K+:36].[K+:37].[O-:38][C:39]([O-:40])=[O:41].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46].[OH2:47]>>[CH3:1][S:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([O:15][CH2:21][CH:22]3[CH2:23][CH2:24][N:25]([c:28]4[n:29][c:30]([CH:33]([CH3:34])[CH3:35])[n:31][o:32]4)[CH2:26][CH2:27]3)[cH:13][n:14]2)[cH:7][cH:8]1