HRID88193

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID9795358

未命名化合物

HCID18435788

Spiro[indole-3,4'-piperidin]-2(1H)-one

C12H14N2O

PRODUCTS

生成物

结构：N#Cc1ccc(Cn2cncc2CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1

HCID9822149

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-91ac789632c34d838f5c34653c33ecb1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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