HRID86297

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID14284

4-(Dimethylamino)pyridine

C7H10N2

HCID33721

4-Piperidone

C5H9NO

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

HCID21288069

未命名化合物

PRODUCTS

产物

HCID13655947

2-(7-Chloro-5-methyl-1,8-naphthyridin-2-yl)-3-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]-2,3-dihydro-1H-isoindol-1-one

C24H21ClN4O3

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8ad298b588c2448cbe673763aaab0af2
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

[CH3:51][N:52]([CH3:53])[c:54]1[cH:55][cH:56][n:57][cH:58][cH:59]1.[CH3:60][N:61]([CH3:62])[CH:63]=[O:64].[CH3:8][CH2:9][N:10]([CH2:11][CH3:12])[CH2:13][CH3:14].[Cl:25][c:26]1[cH:27][c:28]([CH3:50])[c:29]2[cH:30][cH:31][c:32]([N:36]3[CH:37]([CH2:46][C:47](=[O:48])[OH:49])[c:38]4[cH:39][cH:40][cH:41][cH:42][c:43]4[C:44]3=[O:45])[n:33][c:34]2[n:35]1.[NH:1]1[CH2:2][CH2:3][C:4](=[O:7])[CH2:5][CH2:6]1.[OH2:65].[P:15]([C:16]#[N:17])(=[O:18])([O:19][CH2:20][CH3:21])[O:22][CH2:23][CH3:24]>>[N:1]1([C:47]([CH2:46][CH:37]2[N:36]([c:32]3[cH:31][cH:30][c:29]4[c:28]([CH3:50])[cH:27][c:26]([Cl:25])[n:35][c:34]4[n:33]3)[C:44](=[O:45])[c:43]3[c:38]2[cH:39][cH:40][cH:41][cH:42]3)=[O:48])[CH2:2][CH2:3][C:4](=[O:7])[CH2:5][CH2:6]1