HRID1565425

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID18462

DL-10-Camphorsulfonic acid

C10H16O4S

HCID81531

Diisopropylethylamine

C8H19N

HCID21506814

3H-Spiro[2-benzofuran-1,3'-pyrrolidin]-3-one

C11H11NO2

HCID86602277

未命名化合物

PRODUCTS

生成物

结构：Nc1nc(-c2ccc(C3(C(=O)N4CCC5(C4)OC(=O)c4ccccc45)CC3)cc2)cs1

HCID87094917

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7fae9e7842cd436ba4a2cd78285f81ab
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:42]12([CH2:43][S:44]([OH:45])(=[O:46])=[O:47])[C:48]([CH3:49])([CH3:50])[CH:51]([CH2:52][CH2:53]1)[CH2:54][C:55]2=[O:56].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[NH2:10][c:11]1[s:12][cH:13][c:14](-[c:16]2[cH:17][cH:18][c:19]([C:22]3([C:25](=[O:26])[OH:27])[CH2:23][CH2:24]3)[cH:20][cH:21]2)[n:15]1.[NH:28]1[CH2:29][C:30]2([O:31][C:32](=[O:39])[c:33]3[c:34]2[cH:35][cH:36][cH:37][cH:38]3)[CH2:40][CH2:41]1.[O:57]=[CH:58][N:59]([CH3:60])[CH3:61]>>[NH2:10][c:11]1[s:12][cH:13][c:14](-[c:16]2[cH:17][cH:18][c:19]([C:22]3([C:25](=[O:27])[N:28]4[CH2:29][C:30]5([O:31][C:32](=[O:39])[c:33]6[c:34]5[cH:35][cH:36][cH:37][cH:38]6)[CH2:40][CH2:41]4)[CH2:23][CH2:24]3)[cH:20][cH:21]2)[n:15]1