HRID960168

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID1049

Pyridine

C5H5N

HCID7412

Benzoyl chloride

C7H5ClO

结构：Cc1ccc(C2Sc3cc(C)ccc3N(CCN(C)C(=O)OCc3ccccc3)C(=O)C2O)cc1

HCID23318060

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C2Sc3cc(C)ccc3N(CCN(C)C(=O)OCc3ccccc3)C(=O)C2OC(=O)c2ccccc2)cc1

HCID23318079

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9e52b24deeb142fe94625356e44a5cdd
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:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)(=[O:43])[Cl:44].[CH3:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[S:9][c:10]3[c:11]([cH:31][cH:32][c:33]([CH3:35])[cH:34]3)[N:12]([CH2:17][CH2:18][N:19]([CH3:20])[C:21](=[O:22])[O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[C:13](=[O:16])[CH:14]2[OH:15])[cH:6][cH:7]1.[cH:45]1[cH:46][cH:47][n:48][cH:49][cH:50]1.[cH:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[S:9][c:10]3[c:11]([cH:31][cH:32][c:33]([CH3:35])[cH:34]3)[N:12]([CH2:17][CH2:18][N:19]([CH3:20])[C:21](=[O:22])[O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[C:13](=[O:16])[CH:14]2[O:15][C:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)=[O:43])[cH:6][cH:7]1