HRID134892

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCO)CC1

HCID11689240

未命名化合物

PRODUCTS

生成物

结构：CSc1cc(C)nc(SC)c1NC(=O)CN1CCN(CCOS(C)(=O)=O)CC1

HCID22272586

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1bf9bf98cf7d43368c3d93060bc41955
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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