HRID2131450

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID137254

1-Methyl-3-aminopyrazole

C4H7N3

HCID4641409

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

C10H15N6O+

结构：CC(CO[Si](C)(C)C(C)(C)C)Oc1cc(OCc2ccccc2)cc(C(=O)O)c1

HCID68573325

未命名化合物

PRODUCTS

生成物

结构：CC(CO[Si](C)(C)C(C)(C)C)Oc1cc(OCc2ccccc2)cc(C(=O)Nc2ccn(C)n2)c1

HCID67158109

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a2236ca816a14640a49fd7215d72e8de
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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