HRID1240608

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID148428

tert-Butyl S-(4,6-dimethylpyrimidin-2-yl) thiocarbonate

C11H16N2O2S

HCID12838104

未命名化合物

PRODUCTS

生成物

结构：COc1cc(NC(=O)OC(C)(C)C)ccc1OCCCN1CCN(c2ccccc2)CC1

HCID12838111

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a384b69b2e804796bf02e41cd2f93828
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:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31](=[O:32])[S:33][c:34]1[n:35][c:36]([CH3:37])[cH:38][c:39]([CH3:40])[n:41]1.[NH2:1][c:2]1[cH:3][c:4]([O:24][CH3:25])[c:5]([O:6][CH2:7][CH2:8][CH2:9][N:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:14][CH2:15]2)[cH:22][cH:23]1.[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[NH:1]([c:2]1[cH:3][c:4]([O:24][CH3:25])[c:5]([O:6][CH2:7][CH2:8][CH2:9][N:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:14][CH2:15]2)[cH:22][cH:23]1)[C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:32]