HRID687515

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID18465045

2-[(Propan-2-yl)oxy]ethyl methanesulfonate

C6H14O4S

结构：CC(C)(C)OC(=O)N1CCC(Nc2nc3ccccc3[nH]2)CC1

HCID22036999

未命名化合物

PRODUCTS

生成物

结构：CC(C)OCCn1c(NC2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc21

HCID22009477

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0cabafc77f404e3195023c738878574e
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

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