HRID163326

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Cc1ccc(-c2nc(-c3ccc(C)cc3C)nc(-c3ccc(O)cc3O)n2)c(C)c1

HCID74276

4-[4,6-Bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-1,3-benzenediol

C25H23N3O2

结构：CC1(C)CC(OC(=O)CCl)CC(C)(C)N1OC1CCCCC1

HCID19831362

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-c2nc(-c3ccc(C)cc3C)nc(-c3ccc(OCC(=O)OC4CC(C)(C)N(OC5CCCCC5)C(C)(C)C4)cc3O)n2)c(C)c1

HCID135816655

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-578f6bed38cb424b920f992f4c944105
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:23][c:24]1[c:25](-[c:31]2[n:32][c:33](-[c:45]3[c:46]([OH:52])[cH:47][c:48]([OH:51])[cH:49][cH:50]3)[n:34][c:35](-[c:37]3[c:38]([CH3:44])[cH:39][c:40]([CH3:43])[cH:41][cH:42]3)[n:36]2)[cH:26][cH:27][c:28]([CH3:30])[cH:29]1.[Cl:1][CH2:2][C:3](=[O:4])[O:5][CH:6]1[CH2:7][C:8]([CH3:21])([CH3:22])[N:9]([O:14][CH:15]2[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]2)[C:10]([CH3:12])([CH3:13])[CH2:11]1>>[CH2:2]([C:3](=[O:4])[O:5][CH:6]1[CH2:7][C:8]([CH3:21])([CH3:22])[N:9]([O:14][CH:15]2[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]2)[C:10]([CH3:12])([CH3:13])[CH2:11]1)[O:51][c:48]1[cH:47][c:46]([OH:52])[c:45](-[c:33]2[n:32][c:31](-[c:25]3[c:24]([CH3:23])[cH:29][c:28]([CH3:30])[cH:27][cH:26]3)[n:36][c:35](-[c:37]3[c:38]([CH3:44])[cH:39][c:40]([CH3:43])[cH:41][cH:42]3)[n:34]2)[cH:50][cH:49]1