HRID95585

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID81531

Diisopropylethylamine

C8H19N

HCID2760995

N,N-Dimethyloxamic acid

C4H7NO3

HCID4641409

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

C10H15N6O+

结构：CCOC(=O)c1nc2n(c(=O)c1O)CC1CCC2(N)CC1

HCID57905130

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1nc2n(c(=O)c1O)CC1CCC2(NC(=O)C(=O)N(C)C)CC1

HCID57904884

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4e6ed7d9ba7c40e8944b2430c066961e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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