HRID828724

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID313624

6-chloro[1,2,4]triazolo[4,3-b]pyridazine

C5H3ClN4

HCID11739259

1-Piperidinebutanamine, 4-(diphenylmethoxy)-

C22H30N2O

PRODUCTS

生成物

结构：c1ccc(C(OC2CCN(CCCCNc3ccc4nncn4n3)CC2)c2ccccc2)cc1

HCID15524151

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-958b93b6a08147808b5cb7d98ff96f44
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:36]([N:37]([CH:38]([CH3:39])[CH3:40])[CH:41]([CH3:42])[CH3:43])[CH3:44].[CH2:51]([OH:52])[CH2:53][CH2:54][CH3:55].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[Cl:26][c:27]1[cH:28][cH:29][c:30]2[n:31]([n:32]1)[cH:33][n:34][n:35]2.[c:1]1([CH:7]([O:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][CH2:18][NH2:19])[CH2:13][CH2:14]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([O:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][CH2:18][NH:19][c:27]3[cH:28][cH:29][c:30]4[n:31]([n:32]3)[cH:33][n:34][n:35]4)[CH2:13][CH2:14]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1