HRID952513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID6366774

3-fluoropropyl 4-methylbenzenesulfonate

C10H13FO3S

结构：CC(C)c1ccc(S(=O)(=O)Nc2ccc(C3CCNC3)cc2)cc1

HCID57480256

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1ccc(S(=O)(=O)Nc2ccc(C3CCN(CCCF)C3)cc2)cc1

HCID67071393

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4fe6b9f00cf045f18286de9e06398dce
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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