HRID1200854

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID949

N,N-Dimethylaniline

C8H11N

HCID6344

Dichloromethane

CH2Cl2

HCID6420

Trichloroacetyl chloride

C2Cl4O

结构：O=S(=O)(c1ccc(Br)cc1)N1Cc2cccn2Cc2ccccc21

HCID68687871

未命名化合物

PRODUCTS

生成物

结构：O=C(c1ccc2n1Cc1ccccc1N(S(=O)(=O)c1ccc(Br)cc1)C2)C(Cl)(Cl)Cl

HCID68686100

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c2826609ccc2495388857e9b608450b3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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