HRID298543

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID123472

Diethylaminosulfur trifluoride

C4H10F3NS

结构：COc1ccccc1C1(O)CCC(c2ccccc2)(c2ccccc2)C2CN(C(=O)OC(C)(C)C)CC21

HCID21264545

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1C1(F)CCC(c2ccccc2)(c2ccccc2)C2CN(C(=O)OC(C)(C)C)CC21

HCID178489328

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cfd5ba65ce9b4ffe8166919f58238980
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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