HRID1220043

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID614

DL-Proline

C5H9NO2

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID31374

Dimethylacetamide

C4H9NO

结构：CC(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O

HCID21319154

未命名化合物

PRODUCTS

生成物

结构：CC(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N1CCCC1C(=O)O

HCID178460828

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9e9fcb2c281a40eda7cd627068e871ff
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH3:35][N:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[CH3:47][C:48]([N:49]([CH3:50])[CH3:51])=[O:52].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[OH:27][C:28](=[O:29])[CH:30]1[CH2:31][CH2:32][CH2:33][NH:34]1.[c:1]1([C:7]([S:8][CH2:9][CH:10]([C:11](=[O:12])[OH:13])[CH3:14])([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([S:8][CH2:9][CH:10]([C:11](=[O:12])[N:34]2[CH:30]([C:28]([OH:27])=[O:29])[CH2:31][CH2:32][CH2:33]2)[CH3:14])([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1