HRID1574805

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7918

Acetic anhydride

C4H6O3

结构：Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ccc(N)cn2)cc1

HCID19689480

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1ccc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1

HCID19689526

N-[6-[2-{6-(4-tert-butylphenylsulfonylamino)-5-(4-methylphenyl)pyrimidin-4-yloxy}ethoxy]pyridin-3-yl]-acetamide

C30H33N5O5S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5fd51c92f1374b28b1065592116d6eba
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

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