HRID798959

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID15908

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

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

结构：CNC(Cc1ccc2ccccc2c1)C(=O)N(C)C(CNS(C)(=O)=O)Cc1ccccc1

HCID22327186

未命名化合物

HCID54126917

未命名化合物

HCID178516469

未命名化合物

PRODUCTS

生成物

结构：CN(C(=O)C(Cc1ccc2ccccc2c1)N(C)C(=O)C=CCC(C)(C)NC(=O)OC(C)(C)C)C(CNS(C)(=O)=O)Cc1ccccc1

HCID76125572

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d50bebb80b814c31bedf348547c3f9ad
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][CH:11]=[CH:12][C:13](=[O:14])[OH:15])([CH3:16])[CH3:17].[CH2:72]([N:73]([CH:74]([CH3:75])[CH3:76])[CH:77]([CH3:78])[CH3:79])[CH3:80].[CH3:29][N:30]([CH3:31])[CH2:32][CH2:33][CH2:34][N:35]=[C:36]=[N:37][CH2:38][CH3:39].[CH3:40][N:41]([C:42]([CH:43]([CH2:44][c:45]1[cH:46][c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[cH:53][cH:54]1)[NH:55][CH3:56])=[O:57])[CH:58]([CH2:59][NH:60][S:61](=[O:62])(=[O:63])[CH3:64])[CH2:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1.[CH3:81][N:82]([CH3:83])[CH:84]=[O:85].[CH3:89][CH2:90][O:91][C:92](=[O:93])[CH3:94].[Cl:86][CH2:87][Cl:88].[ClH:28].[OH:18][c:19]1[c:20]2[n:21][n:22][nH:23][c:24]2[n:25][cH:26][cH:27]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][CH:11]=[CH:12][C:13](=[O:15])[N:55]([CH:43]([C:42]([N:41]([CH3:40])[CH:58]([CH2:59][NH:60][S:61](=[O:62])(=[O:63])[CH3:64])[CH2:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)=[O:57])[CH2:44][c:45]1[cH:46][c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[cH:53][cH:54]1)[CH3:56])([CH3:16])[CH3:17]