HRID701140

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID24648

Sulfuryl chloride

Cl2O2S

HCID68010

(Trifluoromethoxy)benzene

C7H5F3O

HCID81531

Diisopropylethylamine

C8H19N

HCID12972131

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC(CN(c2ccccc2)S(=O)(=O)c2ccc(OC(F)(F)F)cc2)C1

HCID20632878

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-96ca84cc1818442082484e824eb909da
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

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