HRID2337571

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID1140

Toluene

C7H8

HCID1318

1,10-Phenanthroline

C12H8N2

HCID6115

Aniline

C6H7N

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID104967

Cesium(1+)

Cs+

2 次

HCID16099851

未命名化合物

HCID68870181

未命名化合物

PRODUCTS

生成物

结构：CCn1c(-c2nonc2N)nc2cnc(Oc3cccc(C(=O)C(C)CCN4CCOCC4)c3)cc21

HCID68873842

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-59e2d514fa4a4d80a79e9264ae6d3d3d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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