HRID945397

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID3606994

未命名化合物

结构：CC(C)(Cc1ccccc1)OC(=O)CC1CC(CCl)OC(C)(C)O1

HCID178440823

未命名化合物

PRODUCTS

生成物

结构：CC(C)(Cc1ccccc1)OC(=O)CC1CC(CSc2nnnn2-c2ccccc2)OC(C)(C)O1

HCID178440825

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-284a94864d324ae59e85667441dfb777
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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