HRID806272

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID24386

Thionyl chloride

Cl2OS

HCID13102395

3-Phenyl-4,5-dihydro-1H-pyrazole-5-carboxylic acid

C10H10N2O2

HCID13102401

[Hydroxy(4-phenylbutyl)phosphoryl]acetic acid

C12H17O4P

HCID13102402

未命名化合物

PRODUCTS

生成物

结构：O=C(O)C1CC(c2ccccc2)=NN1C(=O)CP(=O)(O)CCCCc1ccccc1

HCID13102398

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a0b29472f514a9a9c50bb1d311c698e
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

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