HRID1208192

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2064041

4-Acetyl-N,N-dimethyl-benzenesulfonamide

C10H13NO3S

HCID21981006

未命名化合物

结构：COc1cc(OC)c(-c2cccs2)cc1C=CC(=O)c1ccc(S(=O)(=O)Nc2cc(C)on2)cc1

HCID69488043

未命名化合物

PRODUCTS

生成物

结构：COc1cc(OC)c(-c2cc3ccccc3n2C)cc1C=CC(=O)c1ccc(S(=O)(=O)N(C)C)cc1

HCID69490529

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c482c893664b457a9388998e35744976
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

[C:36]([CH3:37])(=[O:38])[c:39]1[cH:40][cH:41][c:42]([S:45](=[O:46])(=[O:47])[N:48]([CH3:49])[CH3:50])[cH:43][cH:44]1.[CH3:1][O:2][c:3]1[cH:4][c:5]([O:6][CH3:7])[c:8](-[c:9]2[s:10][cH:11][cH:12][cH:13]2)[cH:14][c:15]1[CH:16]=[CH:17][C:18]([c:19]1[cH:20][cH:21][c:22]([S:23]([NH:24][c:25]2[cH:26][c:27]([CH3:28])[o:29][n:30]2)(=[O:31])=[O:32])[cH:33][cH:34]1)=[O:35].[CH3:51][O:52][c:53]1[c:54]([CH:55]=[O:56])[cH:57][c:58](-[c:63]2[n:64]([CH3:72])[c:65]3[cH:66][cH:67][cH:68][cH:69][c:70]3[cH:71]2)[c:59]([O:61][CH3:62])[cH:60]1>>[C:36]([CH:37]=[CH:55][c:54]1[c:53]([O:52][CH3:51])[cH:60][c:59]([O:61][CH3:62])[c:58](-[c:63]2[n:64]([CH3:72])[c:65]3[cH:66][cH:67][cH:68][cH:69][c:70]3[cH:71]2)[cH:57]1)(=[O:38])[c:39]1[cH:40][cH:41][c:42]([S:45](=[O:46])(=[O:47])[N:48]([CH3:49])[CH3:50])[cH:43][cH:44]1