HRID803750

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

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID220380

3-(methylsulfonyl)benzoic acid

C8H8O4S

结构：CC(CC(O)C(N)Cc1ccccc1)C(=O)NCCC(C)(C)C

HCID178450601

未命名化合物

PRODUCTS

生成物

结构：CC(CC(O)C(Cc1ccccc1)NC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)NCCC(C)(C)C

HCID21074187

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aae53f559b9749ada4a61df0e4af3e5c
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

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