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2-{[(1Z)-(3-甲基-5-氧代-1-苯基-4,5-二氢-1H-吡唑-4-亚基)(对甲苯基)甲基]氨基}-3-苯基丙酸乙酯

Ethyl 2-{[(1Z)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl-idene)(p-tol-yl)meth-yl]amino}-3-phenyl-propanoate.

作者信息

Zhang Xin, Huang Meng, Du Cong, Han Junjing

机构信息

College of Chemistry and Life Science, Tianjin Normal University, Tianjin 300387, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jan 9;66(Pt 2):o273. doi: 10.1107/S1600536809054865.

DOI:10.1107/S1600536809054865
PMID:21579710
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2979726/
Abstract

The asymmetric unit of the title compound, C(29)H(29)N(3)O(3), contains two mol-ecules, which exist in their enamine-keto form, being stabilized by strong intra-molecular N-H⋯O hydrogen bonds, which generate S(6) loops. In the crystal, inter-molecular C-H⋯O hydrogen bonds link the mol-ecules into chains, which are further linked by weak C-H⋯π inter-actions, forming a two-dimensional network.

摘要

标题化合物C(29)H(29)N(3)O(3)的不对称单元包含两个分子，它们以烯胺-酮形式存在，通过强分子内N-H⋯O氢键稳定，形成S(6)环。在晶体中，分子间C-H⋯O氢键将分子连接成链，这些链通过弱C-H⋯π相互作用进一步连接，形成二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/01ab0020e5a8/e-66-0o273-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/55d88785a0f3/e-66-0o273-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/f67ae11a8833/e-66-0o273-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/01ab0020e5a8/e-66-0o273-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/55d88785a0f3/e-66-0o273-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/f67ae11a8833/e-66-0o273-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b397/2979726/01ab0020e5a8/e-66-0o273-fig3.jpg

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1,5-二甲基-4-{[1-(3-甲基-5-氧代-1-苯基-4,5-二氢-1H-吡唑-4-基亚甲基)乙基]氨基}-2-苯基-1H-吡唑-3(2H)-酮
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