HRID960591

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID73026

3-Hydroxy-1,2,3-benzotriazin-4(3H)-one

C7H5N3O2

结构：CC(C)CC(NC(=O)C(C)(C)NC(=O)OC(C)(C)C)C(=O)O

HCID14314801

未命名化合物

结构：NC1Cc2cccc(N3CCCC3=O)c2N(Cc2ccsc2)C1=O

HCID59620330

未命名化合物

PRODUCTS

生成物

结构：CC(C)CC(NC(=O)C(C)(C)NC(=O)OC(C)(C)C)C(=O)NC1Cc2cccc(N3CCCC3=O)c2N(Cc2ccsc2)C1=O

HCID178446578

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dd5d296553994791a6e9e7bff37a78f7
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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