HRID798811

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1140

Toluene

C7H8

HCID81531

Diisopropylethylamine

C8H19N

HCID351663

O-Methyl-DL-methionine

C6H13NO2S

HCID57672854

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(CCSC)NC(=O)C1(NC(=O)c2cc3ccccc3s2)CCCCC1

HCID74316614

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-76e8457117bb4fb6836907add0753f72
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:11][O:12][C:13]([CH:14]([NH2:15])[CH2:16][CH2:17][S:18][CH3:19])=[O:20].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[ClH:10].[s:21]1[c:22]([C:30]2=[N:31][C:32]3([C:33](=[O:35])[O:34]2)[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]3)[cH:23][c:24]2[c:25]1[cH:26][cH:27][cH:28][cH:29]2>>[CH3:11][O:12][C:13]([CH:14]([NH:15][C:33]([C:32]1([NH:31][C:30]([c:22]2[s:21][c:25]3[c:24]([cH:23]2)[cH:29][cH:28][cH:27][cH:26]3)=[O:34])[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1)=[O:35])[CH2:16][CH2:17][S:18][CH3:19])=[O:20]