HRID134503

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：CC(C)(C)OC(=O)Nc1ccccc1NC(=O)C=Cc1ccn(S(=O)(=O)c2ccc(-c3ccccc3)cc2)c1

HCID66646110

tert-butyl N-[2-[3-[1-(4-phenylphenyl)sulfonylpyrrol-3-yl]prop-2-enoylamino]phenyl]carbamate

C30H29N3O5S

结构：Cc1ccc(S(=O)(=O)n2ccc(C=CC(=O)Nc3ccccc3N)c2)cc1

HCID66646334

未命名化合物

PRODUCTS

生成物

结构：Nc1ccccc1NC(=O)C=Cc1ccn(S(=O)(=O)c2ccc(-c3ccccc3)cc2)c1

HCID66646272

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df2fe1378853403e91ca1bd733ab96bb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:28]([O:29][C:30](=[O:31])[NH:34][c:35]1[c:36]([NH:41][C:42]([CH:43]=[CH:44][c:45]2[cH:46][n:47]([S:50](=[O:51])(=[O:52])[c:53]3[cH:54][cH:55][c:56](-[c:59]4[cH:60][cH:61][cH:62][cH:63][cH:64]4)[cH:57][cH:58]3)[cH:48][cH:49]2)=[O:65])[cH:37][cH:38][cH:39][cH:40]1)([CH3:32])([CH3:33])[CH3:66].[Cl:74][CH2:75][Cl:76].[F:67][C:68]([F:69])([F:70])[C:71]([OH:72])=[O:73].[NH2:1][c:2]1[cH:3][cH:4][cH:5][cH:6][c:7]1[NH:8][C:9](=[O:10])[CH:11]=[CH:12][c:13]1[cH:14][cH:15][n:16]([S:17]([c:18]2[cH:19][cH:20][c:21]([CH3:22])[cH:23][cH:24]2)(=[O:25])=[O:26])[cH:27]1>>[NH2:34][c:35]1[c:36]([NH:41][C:42]([CH:43]=[CH:44][c:45]2[cH:46][n:47]([S:50](=[O:51])(=[O:52])[c:53]3[cH:54][cH:55][c:56](-[c:59]4[cH:60][cH:61][cH:62][cH:63][cH:64]4)[cH:57][cH:58]3)[cH:48][cH:49]2)=[O:65])[cH:37][cH:38][cH:39][cH:40]1