HRID94404

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID5976

1,1-Dimethylhydrazine

C2H8N2

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID181649

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

C5H4N4O

结构：CC(C)(C)OC(=O)N1CCC(Cc2ccccc2)(C(=O)O)CC1

HCID12151020

4-Benzyl-1-(tert-butoxycarbonyl)piperidine-4-carboxylic acid

C18H25NO4

PRODUCTS

生成物

结构：CN(C)NC(=O)C1(Cc2ccccc2)CCN(C(=O)OC(C)(C)C)CC1

HCID20694719

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ccf02de5fcc5415794e1e32688237dd1
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[CH2:12][CH2:13]1.[CH2:35]([N:36]=[C:37]=[N:38][CH2:39][CH2:40][CH2:41][N:42]([CH3:43])[CH3:44])[CH3:45].[CH2:59]([Cl:60])[Cl:61].[CH3:46][N:47]([NH2:48])[CH3:49].[CH:50]([N:51]([CH:52]([CH3:53])[CH3:54])[CH2:55][CH3:56])([CH3:57])[CH3:58].[ClH:34].[OH:24][n:25]1[c:26]2[n:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[NH:48][N:47]([CH3:46])[CH3:49])([CH2:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[CH2:12][CH2:13]1