HRID93931

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

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

C17H14O

HCID104967

Cesium(1+)

Cs+

2 次

HCID572616

3-Amino-2-methylpyridine

C6H8N2

结构：CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21

HCID636044

1,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)

C39H32OP2

HCID86606571

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C(=O)Nc2ccc(F)cn2)c(Nc2cccnc2C)s1

HCID11493914

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4ad6d061bc744c5d83b019fe072ab335
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:68](=[O:69])([O-:70])[O-:71].[CH3:18][c:19]1[n:20][cH:21][cH:22][cH:23][c:24]1[NH2:25].[CH:80]([Cl:81])([Cl:82])[Cl:83].[CH:84](=[CH:85][C:86]([CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1)=[O:95])[c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[Cs+:72].[Cs+:73].[F:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][c:13]([CH3:17])[s:14][c:15]2[Br:16])[n:6][cH:7]1.[O:74]1[CH2:75][CH2:76][O:77][CH2:78][CH2:79]1.[Pd:102].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[c:35]3[c:59]([cH:60][cH:61][cH:62]2)[C:56]([CH3:57])([CH3:58])[c:38]2[c:37]([c:42]([P:43]([c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)[c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:41][cH:40][cH:39]2)[O:36]3)[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12][c:13]([CH3:17])[s:14][c:15]2[NH:25][c:24]2[c:19]([CH3:18])[n:20][cH:21][cH:22][cH:23]2)[n:6][cH:7]1