HRID151740

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID22318564

未命名化合物

结构：CN(C)c1cccc(N(CC(=O)O)S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1

HCID58978433

未命名化合物

PRODUCTS

生成物

结构：CCN(Cc1ncc[nH]1)C(=O)CN(c1cccc(N(C)C)c1)S(=O)(=O)c1ccc(C(C)(C)C)cc1

HCID58978389

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e18034fdec2643af9056274af17cbb57
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:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]([c:15]2[cH:16][c:17]([N:21]([CH3:22])[CH3:23])[cH:18][cH:19][cH:20]2)[CH2:24][C:25](=[O:26])[OH:27])[cH:9][cH:10]1.[CH2:28]([CH3:29])[NH:30][CH2:31][c:32]1[nH:33][cH:34][cH:35][n:36]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]([c:15]2[cH:16][c:17]([N:21]([CH3:22])[CH3:23])[cH:18][cH:19][cH:20]2)[CH2:24][C:25](=[O:26])[N:30]([CH2:28][CH3:29])[CH2:31][c:32]2[nH:33][cH:34][cH:35][n:36]2)[cH:9][cH:10]1