HRID816851

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID28486

Lithium ion

Li+

HCID76335

3,3-Dimethylbutyraldehyde

C6H12O

HCID852078

1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

C13H10N2O2S

HCID5062348

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)CC(O)c1cc2cccnc2n1S(=O)(=O)c1ccccc1

HCID67229606

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2276d800da1c44f7821a0d8bd5d9479f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:27]([Li:28])[CH2:29][CH2:30][CH3:31].[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[CH3:45][C:46]([CH2:47][CH:48]=[O:49])([CH3:50])[CH3:51].[CH:19]([N-:20][CH:21]([CH3:22])[CH3:23])([CH3:24])[CH3:25].[CH:38]([NH:39][CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Li+:26].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][cH:17][cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[c:11]([CH:48]([CH2:47][C:46]([CH3:45])([CH3:50])[CH3:51])[OH:49])[cH:12][c:13]3[c:14]2[n:15][cH:16][cH:17][cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1