化工社
首页MCP工作台Skills
首页工作台通知我的
llms.txt · MCP 指南隐私政策 · 服务条款 · 支持v1.8.0
  1. 首页
  2. /反应

醋酸 → (E)-tert-Butyl 2-(6-(2-(4-(4-fluorophenyl)-6-isopropyl-2-(N-methylmethylsulfonamido)pyrimidin-5-yl)vinyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate

HRID 1237685
笔记
打印预览

反应方程式

HRID 1237685 反应方程式
[Br:1][c:2]1[c:3](-[c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)[n:4][c:5]([N:11]([S:12](=[O:13])(=[O:14])[CH3:15])[CH3:16])[n:6][c:7]1[CH:8]([CH3:9])[CH3:10].[CH3:24][C:25]1([CH3:41])[O:26][CH:27]([CH:39]=[CH2:40])[CH2:28][CH:29]([CH2:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[O:30]1.[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[CH3:69][C:70](=[O:71])[OH:72].[CH:42]1([CH2:43][NH:44][CH2:45][CH:46]2[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]2)[CH2:52][CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:68]>>[c:2]1([CH:40]=[CH:39][CH:27]2[O:26][C:25]([CH3:24])([CH3:41])[O:30][CH:29]([CH2:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:28]2)[c:3](-[c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)[n:4][c:5]([N:11]([S:12](=[O:13])(=[O:14])[CH3:15])[CH3:16])[n:6][c:7]1[CH:8]([CH3:9])[CH3:10]
参与物来源与证据反应笔记

参与物

8

反应物 7

HCID 176醋酸HCID 962聚[6-[4-(4-氰基苯基)苯氧基]己基甲基丙烯酸酯]HCID 6228N,N-二甲基甲酰胺HCID 8857乙酸乙酯HCID 4594378Bis(cyclohexylmethyl)amineHCID 11495059N-(5-Bromo-4-(4-fluorophenyl)-6-isopropylpyrimidin-2-yl)-N-methylmethanesulfonamideHCID 77274669
Tert-butyl 2-(6-ethenyl-2,2-dimethyl-1,3-dioxan-4-yl)acetate

产物 1

HCID 53395082(E)-tert-Butyl 2-(6-(2-(4-(4-fluorophenyl)-6-isopropyl-2-(N-methylmethylsulfonamido)pyrimidin-5-yl)vinyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate

来源与证据

ORD记录
ord-33e3bf1590b54eb6b49d1a00e12de628
来源数据集
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

反应笔记

加载中…

本页导航参与物来源与证据反应笔记