HRID88906

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID19660

Carbonate

CO3-2

HCID28557

18-Crown-6

C12H24O6

HCID31297

Methanesulfonyl chloride

CH3ClO2S

HCID735736

Tert-butyl 4-(2-hydroxyethyl)piperazine-1-carboxylate

C11H22N2O3

HCID178527775

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCN(CCSc2nc3ccccc3[nH]2)CC1

HCID23084891

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c7d8c9ba11354814864d2707bc36b086
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:39](=[O:40])([O-:41])[O-:42].[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[N:15]1[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][OH:23])[CH2:19][CH2:20]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:24][S:25](=[O:26])(=[O:27])[Cl:28].[K+:43].[K+:44].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50][O:51][CH2:52][CH2:53][O:54][CH2:55][CH2:56][O:57][CH2:58][CH2:59][O:60][CH2:61][CH2:62]1.[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1.[SH:29][c:30]1[nH:31][c:32]2[c:33]([n:34]1)[cH:35][cH:36][cH:37][cH:38]2>>[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[N:15]1[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][S:29][c:30]2[n:31][c:32]3[c:33]([nH:34]2)[cH:35][cH:36][cH:37][cH:38]3)[CH2:19][CH2:20]1