HRID166508

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID181649

3H-1,2,3-Triazolo[4,5-b]pyridine, 3-hydroxy-

C5H4N4O

HCID1268079

2-Hydrazino-4-(trifluoromethyl)pyrimidine

C5H5F3N4

HCID58016118

1-{[(Benzyloxy)(formyl)amino]methyl}cyclohexane-1-carboxylic acid

C16H21NO4

PRODUCTS

生成物

结构：O=CN(CC1(C(=O)NNc2nccc(C(F)(F)F)n2)CCCCC1)OCc1ccccc1

HCID86606473

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-766a9c5788be4d45a80277d2709cffdd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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