HRID1117863

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

HCID8471

Triethylamine

C6H15N

结构：O=C(Cc1ccccc1N1CCCC1)N1CC2CC(CO)CC(O)(c3ccccc3F)C2C1

HCID86752420

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)OCC2CC3CN(C(=O)Cc4ccccc4N4CCCC4)CC3C(O)(c3ccccc3F)C2)cc1

HCID86752419

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7e54ae487f344430bd2dd8e8035fc857
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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