HRID1551912

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID7052

2,4-Dimethoxybenzoic acid

C9H10O4

HCID8028

Tetrahydrofuran

C4H8O

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+

HCID22507697

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)Nc2nc3c(OC)ccc(C4COCCO4)c3s2)c(OC)c1

HCID22507748

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3e61df062e2743bb84e521a0339a9499
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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