HRID190108

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8058

n-Hexane

C6H14

结构：CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(N)cc1

HCID10804475

N-tert-butyl-4'-aminobiphenyl-2-sulfonamide

C16H20N2O2S

HCID16682925

Aluminum, trimethyl-

C3H9Al

HCID54296942

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(=CC(=O)Nc1ccc(-c2ccccc2S(=O)(=O)NC(C)(C)C)cc1)c1cccc(C#N)c1

HCID53874782

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-871ade840c5c48d2a1da9b19faf504cc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[c:10](-[c:15]2[cH:16][cH:17][c:18]([NH2:21])[cH:19][cH:20]2)[cH:11][cH:12][cH:13][cH:14]1.[C:32](#[N:33])[c:34]1[cH:35][c:36]([C:40](=[CH:41][C:42](=[O:43])[O:44][CH3:45])[CH:46]([CH3:47])[CH3:48])[cH:37][cH:38][cH:39]1.[CH3:22][Al:23]([CH3:24])[CH3:25].[CH3:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31].[Cl:49][CH2:50][Cl:51]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[c:10](-[c:15]2[cH:16][cH:17][c:18]([NH:21][C:42]([CH:41]=[C:40]([c:36]3[cH:35][c:34]([C:32]#[N:33])[cH:39][cH:38][cH:37]3)[CH:46]([CH3:47])[CH3:48])=[O:43])[cH:19][cH:20]2)[cH:11][cH:12][cH:13][cH:14]1