HRID2145278

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID138928

2-Phenyl-4-carboxythiazole

C10H7NO2S

HCID4641409

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

C10H15N6O+

HCID53302318

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

C13H24N2O3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)c1csc(-c3ccccc3)n1)CCO2

HCID57989358

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dcd2c11d311e480698a2758460e067c4
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

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