HRID166271

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

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

HCID11127991

3-Bromo-5-(trifluoromethyl)pyridine

C6H3BrF3N

HCID86606574

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(NC(=O)c2nc(C)sc2Nc2cncc(C(F)(F)F)c2)ccn1

HCID86606576

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7407955e2c624af087c41c0d63da991c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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