HRID1555288

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID166653

Hydride

H-

结构：Cc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)c2oc(C(N)=O)c(Cc3ccccc3)c2c1

HCID59344904

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1oc2c(N3CCN(C(=O)OC(C)(C)C)CC3)cc(C)cc2c1Cc1ccccc1

HCID59344901

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b3bdb5fc9a304e5996ad45faf9d52b2b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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