HRID806237

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID8003

Pentane

C5H12

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID2764053

6-Chloronicotinaldehyde

C6H4ClNO

HCID4496004

tert-butyl 4-(methylsulfonyl)piperazine-1-carboxylate

C10H20N2O4S

HCID178418306

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCN(S(=O)(=O)CC(O)c2ccc(Cl)nc2)CC1

HCID22709547

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-105dec55fe9044fcaa98c809e27617cb
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

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