HRID160007

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID10928

Ethyl chloroformate

C3H5ClO2

HCID117295

1-Ethylpyrrolidin-2-ylmethylamine

C7H16N2

HCID13690886

未命名化合物

PRODUCTS

生成物

结构：CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)cc2c1OC(C)C2

HCID13420575

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-367502147a1f458f88aef1b28226cd49
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:23]([Cl:24])(=[O:25])[O:26][CH2:27][CH3:28].[CH3:18][N:19]([CH3:20])[CH:21]=[O:22].[CH3:1][CH:2]1[O:3][c:4]2[c:5]([cH:7][c:8]([S:14]([NH2:15])(=[O:16])=[O:17])[cH:9][c:10]2[C:11](=[O:12])[OH:13])[CH2:6]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:46][C:47](=[O:48])[CH3:49].[NH2:29][CH2:30][CH:31]1[N:32]([CH2:36][CH3:37])[CH2:33][CH2:34][CH2:35]1.[OH2:38]>>[CH3:1][CH:2]1[O:3][c:4]2[c:5]([cH:7][c:8]([S:14]([NH2:15])(=[O:16])=[O:17])[cH:9][c:10]2[C:11](=[O:13])[NH:29][CH2:30][CH:31]2[N:32]([CH2:36][CH3:37])[CH2:33][CH2:34][CH2:35]2)[CH2:6]1