HRID958597

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

HCID4641409

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

C10H15N6O+

HCID21830061

未命名化合物

HCID59496649

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(-c2ccccc2)cc1)NC(=O)c1ccc2c(N3CCN(C)CC3)nc(N)nc2c1

HCID75290856

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-678d8ef64dde4695b8f0d4015d1bb298
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:74][N:75]([CH3:76])[CH:77]=[O:78].[CH3:8][N+:9]([CH3:10])=[C:11]([N:12]([CH3:13])[CH3:14])[O:15][n:16]1[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1.[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[NH2:25][c:26]1[n:27][c:28]2[cH:29][c:30]([C:43](=[O:44])[OH:45])[cH:31][cH:32][c:33]2[c:34]([N:36]2[CH2:37][CH2:38][N:39]([CH3:42])[CH2:40][CH2:41]2)[n:35]1.[NH2:55][CH:56]([C:57](=[O:58])[O:59][CH3:60])[CH2:61][c:62]1[cH:63][cH:64][c:65](-[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[cH:66][cH:67]1.[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7]>>[NH2:25][c:26]1[n:27][c:28]2[cH:29][c:30]([C:43](=[O:44])[NH:55][CH:56]([C:57](=[O:58])[O:59][CH3:60])[CH2:61][c:62]3[cH:63][cH:64][c:65](-[c:68]4[cH:69][cH:70][cH:71][cH:72][cH:73]4)[cH:66][cH:67]3)[cH:31][cH:32][c:33]2[c:34]([N:36]2[CH2:37][CH2:38][N:39]([CH3:42])[CH2:40][CH2:41]2)[n:35]1