HRID305399

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3526523

4-amino-3-bromobenzenesulfonamide

C6H7BrN2O2S

结构：Cc1cc(C#N)ccc1Oc1ccc(CC(=O)Nc2ccc(S(N)(=O)=O)cc2Cl)c(C)c1C

HCID49768067

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C#N)ccc1Oc1ccc(CC(=O)Nc2ccc(S(N)(=O)=O)cc2Br)c(C)c1C

HCID16223863

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-97f6bba800f74d3c81602c30d2a257cb
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

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