HRID957452

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID923

Sodium ion

Na+

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID3014145

未命名化合物

结构：CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Oc2ccccc2)CN(C2CCCCC2)c2ccccc21

HCID22709427

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)C(=O)CN1C(=O)C(NC(=O)Nc2cccc(C(=O)O)c2)CN(C2CCCCC2)c2ccccc21

HCID22709424

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-664dcb1ebf5e4b6fac7be3c533d39c47
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:12]([CH3:13])([CH3:14])([CH3:15])[C:16](=[O:17])[CH2:18][N:19]1[C:20](=[O:46])[CH:21]([NH:36][C:37](=[O:38])[O:39][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[CH2:22][N:23]([CH:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]2)[c:24]2[c:25]1[cH:26][cH:27][cH:28][cH:29]2.[CH3:47][N:48]([CH3:49])[c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1.[CH3:56][S:57]([CH3:58])=[O:59].[NH2:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[O-:7])[cH:8][cH:9][cH:10]1.[Na+:11]>>[NH:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][cH:10]1)[C:37]([NH:36][CH:21]1[C:20](=[O:46])[N:19]([CH2:18][C:16]([C:12]([CH3:13])([CH3:14])[CH3:15])=[O:17])[c:25]2[c:24]([cH:29][cH:28][cH:27][cH:26]2)[N:23]([CH:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]2)[CH2:22]1)=[O:38]