HRID956759

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID25067323

Methyl 4-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-6-carboxylate

C12H14O4

HCID53629639

(Azetidin-1-yl)(5-bromopyrimidin-2-yl)methanone

C8H8BrN3O

结构：COC(=O)c1cc(Oc2ccc(C(=O)N(C)C)nc2)c2c(c1)OC(C)(C)C2

HCID59560224

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(Oc2cnc(C(=O)N3CCC3)nc2)c2c(c1)OC(C)(C)C2

HCID59560106

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f2710086120a466490fe3da6d2c3f3f7
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

[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([c:14]([O:16][c:17]3[cH:18][n:19][c:20]([C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[cH:26][cH:27]3)[cH:15]1)[CH2:9][C:10]([CH3:12])([CH3:13])[O:11]2.[CH3:41][O:42][C:43]([c:44]1[cH:45][c:46]([OH:47])[c:48]2[c:54]([cH:55]1)[O:53][C:50]([CH3:51])([CH3:52])[CH2:49]2)=[O:56].[N:28]1([C:32](=[O:33])[c:34]2[n:35][cH:36][c:37]([Br:40])[cH:38][n:39]2)[CH2:29][CH2:30][CH2:31]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([c:14]([O:16][c:37]3[cH:36][n:35][c:34]([C:32]([N:28]4[CH2:29][CH2:30][CH2:31]4)=[O:33])[n:39][cH:38]3)[cH:15]1)[CH2:9][C:10]([CH3:12])([CH3:13])[O:11]2