HRID185794

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID98928

4-Thiazolidinecarboxylic acid, 3-acetyl-

C6H9NO3S

结构：COC(=O)C(N)CNC(=O)N1CCC2(CC1)C(=O)N(C)CN2c1ccccc1

HCID69562941

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(CNC(=O)N1CCC2(CC1)C(=O)N(C)CN2c1ccccc1)NC(=O)C1CSCN1C(C)=O

HCID22350009

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f7faba1491f34eb799190e4adc16ddb3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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