HRID662553

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID181649

3H-1,2,3-Triazolo[4,5-b]pyridine, 3-hydroxy-

C5H4N4O

HCID21866158

未命名化合物

HCID21866332

1-(tert-Butoxycarbonyl)-2-methylazetidine-2-carboxylic acid

C10H17NO4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC1(C)C(=O)N1CCCC1C(=O)NCc1cc(Cl)ccc1-n1cnnn1

HCID178451530

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccaa3880b73d4ba581fe6cf4695488f4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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