HRID828127

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCOc1nc(C(C)(C)C)ncc1C1=NC(C)(c2ccc(Cl)cc2)C(C)(c2ccc(Cl)cc2)N1C(=O)Cl

HCID76588520

未命名化合物

结构：CCOc1cc(C(C)(C)C)ncc1C1=NC(C)(c2ccc(Cl)cc2)C(C)(c2ccc(Cl)cc2)N1C(=O)N1CCC(CCS(C)(=O)=O)CC1

HCID178466391

未命名化合物

PRODUCTS

生成物

结构：CCOc1nc(C(C)(C)C)ncc1C1=NC(C)(c2ccc(Cl)cc2)C(C)(c2ccc(Cl)cc2)N1C(=O)N1CCC(CCS(C)(=O)=O)CC1

HCID178467413

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4abe819ef0894fb6bba09dfe1dec265e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][cH:7][c:8]([C:14]2=[N:18][C:17]([CH3:19])([c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[C:16]([CH3:27])([c:28]3[cH:29][cH:30][c:31]([Cl:34])[cH:32][cH:33]3)[N:15]2[C:35](=[O:36])[Cl:37])[c:9]([O:11][CH2:12][CH3:13])[n:10]1.[C:38]([c:39]1[n:40][cH:41][c:42]([C:43]2=[N:65][C:56]([c:57]3[cH:58][cH:59][c:60]([Cl:61])[cH:62][cH:63]3)([CH3:64])[C:47]([c:48]3[cH:49][cH:50][c:51]([Cl:52])[cH:53][cH:54]3)([CH3:55])[N:44]2[C:45](=[O:46])[N:71]2[CH2:72][CH2:73][CH:74]([CH2:77][CH2:78][S:79](=[O:80])(=[O:81])[CH3:82])[CH2:75][CH2:76]2)[c:66]([O:67][CH2:68][CH3:69])[cH:70]1)([CH3:83])([CH3:84])[CH3:85]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][cH:7][c:8]([C:14]2=[N:18][C:17]([CH3:19])([c:20]3[cH:21][cH:22][c:23]([Cl:26])[cH:24][cH:25]3)[C:16]([CH3:27])([c:28]3[cH:29][cH:30][c:31]([Cl:34])[cH:32][cH:33]3)[N:15]2[C:35](=[O:36])[N:71]2[CH2:72][CH2:73][CH:74]([CH2:77][CH2:78][S:79](=[O:80])(=[O:81])[CH3:82])[CH2:75][CH2:76]2)[c:9]([O:11][CH2:12][CH3:13])[n:10]1