HRID806951

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID887

Methanol

CH4O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID31275

1,4-Dioxane

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID596264

未命名化合物

HCID4641409

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

C10H15N6O+

HCID66728214

未命名化合物

PRODUCTS

生成物

结构：COC(=O)NC(C(=O)N1CCCC1C(=O)Nc1cc(C(C)=O)ccc1C)c1ccccc1

HCID178502185

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-444bfabbd2b543ddbac4735348d57543
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:32]([CH3:33])(=[O:34])[c:35]1[cH:36][cH:37][c:38]([CH3:49])[c:39]([NH:41][C:42](=[O:43])[CH:44]2[NH:45][CH2:46][CH2:47][CH2:48]2)[cH:40]1.[CH3:51][O:52][C:53](=[O:54])[NH:55][CH:56]([C:57](=[O:58])[OH:59])[c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[CH3:75][OH:76].[CH3:77][N:78]([CH3:79])[CH:80]=[O:81].[CH:66]([N:67]([CH2:68][CH3:69])[CH:70]([CH3:71])[CH3:72])([CH3:73])[CH3:74].[ClH:1].[ClH:50].[O:2]1[CH2:3][CH2:4][O:5][CH2:6][CH2:7]1.[P-:8]([F:9])([F:10])([F:11])([F:12])([F:13])[F:14].[n:15]1([O:16][C:17]([N:18]([CH3:19])[CH3:20])=[N+:21]([CH3:22])[CH3:23])[c:24]2[n:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1>>[C:32]([CH3:33])(=[O:34])[c:35]1[cH:36][cH:37][c:38]([CH3:49])[c:39]([NH:41][C:42](=[O:43])[CH:44]2[N:45]([C:57]([CH:56]([NH:55][C:53]([O:52][CH3:51])=[O:54])[c:60]3[cH:61][cH:62][cH:63][cH:64][cH:65]3)=[O:58])[CH2:46][CH2:47][CH2:48]2)[cH:40]1