HRID701735

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID68263

1,1'-Carbonylbis(1H-imidazole)

C7H6N4O

HCID72879

Methanesulfonamide

CH5NO2S

HCID166653

Hydride

H-

结构：CC1(C)Cc2cc(C(=O)O)cc(Cl)c2NC1c1cccc(N2CCOCC2)c1

HCID58476207

未命名化合物

PRODUCTS

生成物

结构：CC1(C)Cc2cc(C(=O)NS(C)(=O)=O)cc(Cl)c2NC1c1cccc(N2CCOCC2)c1

HCID67441097

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-75ca0cf9bef7479dbf794e280c78c335
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:36]([n:37]1[cH:38][cH:39][n:40][cH:41]1)([n:42]1[cH:43][cH:44][n:45][cH:46]1)=[O:47].[CH3:3][S:4](=[O:5])(=[O:6])[NH2:7].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[Cl:8][c:9]1[cH:10][c:11]([C:33](=[O:34])[OH:35])[cH:12][c:13]2[c:18]1[NH:17][CH:16]([c:19]1[cH:20][c:21]([N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[cH:22][cH:23][cH:24]1)[C:15]([CH3:31])([CH3:32])[CH2:14]2.[H-:1].[Na+:2]>>[CH3:3][S:4](=[O:5])(=[O:6])[NH:7][C:33]([c:11]1[cH:10][c:9]([Cl:8])[c:18]2[c:13]([cH:12]1)[CH2:14][C:15]([CH3:31])([CH3:32])[CH:16]([c:19]1[cH:20][c:21]([N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[cH:22][cH:23][cH:24]1)[NH:17]2)=[O:34]