HRID2156847

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID4641409

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

C10H15N6O+

HCID22499307

4-(Propan-2-yl)-1,3-thiazole-2-carboxylic acid

C7H9NO2S

HCID53302318

tert-Butyl 1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate

C13H24N2O3

PRODUCTS

生成物

结构：CC(C)c1csc(C(=O)N2CCOC3(CCN(C(=O)OC(C)(C)C)CC3)C2)n1

HCID57988958

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-56a15129e48642dd898c70b52d82c7a1
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

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