HRID1539743

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID2737531

4-Amino-1-methylpiperidine

C6H14N2

结构：CC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)Cl)s2)s1

HCID86622562

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)NC3CCN(C)CC3)s2)s1

HCID11998304

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ce93515b6ab444b4970b1e632e804dcb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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