HRID98617

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID6212

Chloroform

CHCl3

HCID12783827

5-[(6-Methylpyridin-3-yl)methyl]-2-(methylsulfanyl)pyrimidin-4(3H)-one

C12H13N3OS

HCID13189825

1-Amino-3-{3-[(piperidin-1-yl)methyl]phenoxy}propan-2-ol

C15H24N2O2

PRODUCTS

生成物

结构：Cc1ccc(Cc2cnc(NCC(O)COc3cccc(CN4CCCCC4)c3)[nH]c2=O)cn1

HCID20246025

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fb28b0a27c8643c6bbd74050ac5a3640
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

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