HRID1219698

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID62325

2-Methylpropanoyl chloride

C4H7ClO

HCID81531

Diisopropylethylamine

C8H19N

结构：CCCN(CC1CCN(S(C)(=O)=O)CC1)C1CCc2ccc(N)cc2C1

HCID21362805

未命名化合物

PRODUCTS

生成物

结构：CCCN(CC1CCN(S(C)(=O)=O)CC1)C1CCc2ccc(NC(=O)C(C)C)cc2C1

HCID21362784

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e60bde5774d8441ca7250f858264d50b
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

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