HRID1133428

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID14232

N-Methoxymethylamine

C2H7NO

HCID15908

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

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID181649

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

C5H4N4O

HCID17750399

5-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid

C13H17NO4S

PRODUCTS

生成物

结构：CON(C)C(=O)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2

HCID86635664

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b07300db435d44fda6cc2f55a09a9709
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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