HRID197102

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID123238

1-Azabicyclo[2.2.2]octan-3-amine

C7H14N2

HCID737737

5-bromo-1-benzothiophene-2-carboxylic acid

C9H5BrO2S

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID17982764

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-91d65143a4b04602b65ff8fa94cd84d0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:7][c:8]([C:10](=[O:11])[OH:12])[s:9]2)[cH:13]1.[CH:49]([N:50]([CH2:51][CH3:52])[CH:53]([CH3:54])[CH3:55])([CH3:56])[CH3:57].[ClH:14].[ClH:15].[NH2:16][CH:17]1[CH2:18][N:19]2[CH2:20][CH2:21][CH:22]1[CH2:23][CH2:24]2.[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[P-:25]([F:26])([F:27])([F:28])([F:29])([F:30])[F:31].[n:32]1([O:33][C:34]([N:35]([CH3:36])[CH3:37])=[N+:38]([CH3:39])[CH3:40])[c:41]2[n:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:7][c:8]([C:10](=[O:12])[NH:16][CH:17]3[CH2:18][N:19]4[CH2:20][CH2:21][CH:22]3[CH2:23][CH2:24]4)[s:9]2)[cH:13]1.[ClH:14]