HRID946681

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID181649

3H-1,2,3-Triazolo[4,5-b]pyridine, 3-hydroxy-

C5H4N4O

HCID13375415

未命名化合物

HCID59565474

未命名化合物

PRODUCTS

生成物

结构：C#Cc1cnc2ccc(OC(SC)C(=O)NC(C)(CO)COC)cc2c1

HCID59565371

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-47f1a10483444acc85fcaa65d9caf9ef
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

[B-:30]([F:31])([F:32])([F:33])[F:34].[C:1](#[CH:2])[c:3]1[cH:4][n:5][c:6]2[cH:7][cH:8][c:9]([O:13][CH:14]([C:15](=[O:16])[OH:17])[S:18][CH3:19])[cH:10][c:11]2[cH:12]1.[CH3:62][C:63]#[N:64].[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[CH3:71][CH2:72][N:73]([CH2:74][CH3:75])[CH2:76][CH3:77].[Cl-:60].[NH2:52][C:53]([CH2:54][OH:55])([CH2:56][O:57][CH3:58])[CH3:59].[NH4+:61].[OH:20][n:21]1[c:22]2[n:23][cH:24][cH:25][cH:26][c:27]2[n:28][n:29]1.[n:35]1([O:36][C:37]([N:38]([CH3:39])[CH3:40])=[N+:41]([CH3:42])[CH3:43])[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[n:50][n:51]1>>[C:1](#[CH:2])[c:3]1[cH:4][n:5][c:6]2[cH:7][cH:8][c:9]([O:13][CH:14]([C:15](=[O:17])[NH:52][C:53]([CH2:54][OH:55])([CH2:56][O:57][CH3:58])[CH3:59])[S:18][CH3:19])[cH:10][c:11]2[cH:12]1