HRID698843

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID11579235

2-THIAZOLESULFONYL CHLORIDE

C3H2ClNO2S2

结构：COC(=O)CCc1cccc(CNCc2ccc(C(C)(C)C)cc2)c1

HCID54364343

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CCc1cccc(CN(Cc2ccc(C(C)(C)C)cc2)S(=O)(=O)c2nccs2)c1

HCID54191571

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4197e20889784a4087c35d6f48c5c38d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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