HRID306218

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID28486

Lithium ion

Li+

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID3280088

未命名化合物

HCID11586522

4-Bromo-6-chloropyridazin-3(2H)-one

C4H2BrClN2O

HCID58043933

5-Methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-amine

C7H12N4

PRODUCTS

生成物

HCID58540316

6-Chloro-4-[(4,5,6,7-tetrahydro-5-methylpyrazolo[1,5-a]pyrazin-2-yl)amino]-3(2H)-pyridazinone

C11H13ClN6O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8f4164522c1047aeb3aa81ffa7a80787
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:12][c:13]1[c:14](=[O:20])[nH:15][n:16][c:17]([Cl:19])[cH:18]1.[CH2:89]1[O:90][CH2:91][CH2:92][CH2:93]1.[CH2:94]1[O:95][CH2:96][CH2:97][O:98][CH2:99]1.[CH3:1][N:2]1[CH2:3][c:4]2[n:5]([n:8][c:9]([NH2:11])[cH:10]2)[CH2:6][CH2:7]1.[CH3:22][Si:23]([N-:24][Si:25]([CH3:26])([CH3:27])[CH3:28])([CH3:29])[CH3:30].[CH:34](=[CH:35][C:36]([CH:37]=[CH:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)=[O:45])[c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[CH:52](=[CH:53][C:54]([CH:55]=[CH:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)=[O:63])[c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[CH:70](=[CH:71][C:72]([CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1)=[O:81])[c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1.[ClH:31].[Li+:21].[OH2:88].[Pd:32].[Pd:33]>>[CH3:1][N:2]1[CH2:3][c:4]2[n:5]([n:8][c:9]([NH:11][c:13]3[c:14](=[O:20])[nH:15][n:16][c:17]([Cl:19])[cH:18]3)[cH:10]2)[CH2:6][CH2:7]1