HRID934741

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID20394

2-(Chloromethyl)quinoline

C10H8ClN

HCID104967

Cesium(1+)

Cs+

2 次

HCID59797506

未命名化合物

PRODUCTS

生成物

结构：c1ccc2nc(COc3ccc(-n4cncc4-c4ccncc4)cc3)ccc2c1

HCID11710611

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7eec8a8de74047ec93ec548f19d1e19d
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:32](=[O:33])([O-:34])[O-:35].[C:47]([O:48][CH2:49][CH3:50])(=[O:51])[CH3:52].[CH2:42]([OH:43])[CH2:44][CH2:45][CH3:46].[CH3:38][S:39]([CH3:40])=[O:41].[Cl:20][CH2:21][c:22]1[n:23][c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[cH:30][cH:31]1.[ClH:19].[Cs+:36].[Cs+:37].[n:1]1[cH:2][cH:3][c:4](-[c:7]2[cH:8][n:9][cH:10][n:11]2-[c:12]2[cH:13][cH:14][c:15]([OH:18])[cH:16][cH:17]2)[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4](-[c:7]2[cH:8][n:9][cH:10][n:11]2-[c:12]2[cH:13][cH:14][c:15]([O:18][CH2:21][c:22]3[n:23][c:24]4[cH:25][cH:26][cH:27][cH:28][c:29]4[cH:30][cH:31]3)[cH:16][cH:17]2)[cH:5][cH:6]1