HRID810201

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6212

Chloroform

CHCl3

HCID31275

1,4-Dioxane

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

HCID123584

Methyl 3-amino-4-methylthiophene-2-carboxylate

C7H9NO2S

HCID151417

Glycine tert-butyl ester

C6H13NO2

HCID67429695

未命名化合物

结构：Cc1csc2c(O)c(C(=O)NCC(=O)OC(C)(C)C)c(=O)n(C)c12

HCID67430837

未命名化合物

PRODUCTS

生成物

结构：Cc1csc2c(O)c(C(=O)NCC(=O)O)c(=O)n(C)c12

HCID54749370

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-90db1fb23d5646ccada256753669e82b
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

[CH:70]([N:71]([CH2:72][CH3:73])[CH:74]([CH3:75])[CH3:76])([CH3:77])[CH3:78].[Cl:79][CH:80]([Cl:81])[Cl:82].[ClH:54].[NH2:43][c:44]1[c:45]([CH3:46])[cH:47][s:48][c:49]1[C:50]([O:51][CH3:52])=[O:53].[NH2:55][CH2:56][C:57]([O:58][C:59]([CH3:60])([CH3:61])[CH3:62])=[O:63].[O:64]1[CH2:65][CH2:66][O:67][CH2:68][CH2:69]1.[OH:1][c:2]1[c:3]2[c:4]([n:5]([CH3:20])[c:6](=[O:19])[c:7]1[C:8](=[O:9])[NH:10][CH2:11][C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[c:21]([CH3:24])[cH:22][s:23]2.[OH:25][c:26]1[c:27]2[s:28][cH:29][c:30]([CH3:31])[c:32]2[n:33]([CH3:34])[c:35](=[O:36])[c:37]1[C:38]([O:39][CH2:40][CH3:41])=[O:42]>>[OH:1][c:2]1[c:3]2[c:4]([n:5]([CH3:20])[c:6](=[O:19])[c:7]1[C:8](=[O:9])[NH:10][CH2:11][C:12](=[O:13])[OH:14])[c:21]([CH3:24])[cH:22][s:23]2