HRID303979

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6738

2-Hydroxy-3-methylbenzoic acid

C8H8O3

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID15524434

未命名化合物

PRODUCTS

生成物

HCID59314262

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ad40b001ae2045bca03a73948bff97df
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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