HRID116938

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID4574913

未命名化合物

HCID21897744

1-[3-(Propan-2-yl)-1,2,4-oxadiazol-5-yl]piperidin-4-ol

C10H17N3O2

HCID86597362

未命名化合物

PRODUCTS

生成物

结构：Cc1c(Nc2ccc(S(C)(=O)=O)cc2F)ncnc1OC1CCN(c2nc(C(C)C)no2)CC1

HCID59856820

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd8ad52d799a49f38a571e2cd4e4ae2c
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

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