HRID805694

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID21041229

未命名化合物

HCID21979532

未命名化合物

PRODUCTS

产物

HCID21979560

Benzylsulfamic acid [6-[2-(5-methylsulfanyl-pyrimidin-2-yloxy)ethoxy]-5-(2-chloro-5-methoxy-phenoxy)pyrimidin-4-yl]-amide

C25H25ClN6O6S2

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-1c6ec9250de74f1fabfd2068021b41a8
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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