HRID2131621

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1241301

2-Thiophenesulfonamide, 5-chloro-

C4H4ClNO2S2

结构：CCc1nc2c(C)cc(C)nc2n1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1

HCID21875619

未命名化合物

PRODUCTS

生成物

结构：CCc1nc2c(C)cc(C)nc2n1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(Cl)s2)cc1

HCID21876084

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1e7b522fe0d482eb8119d0148b6a2c9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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