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1-(1,3-苯并噻唑-2-基)-3-苯甲酰基硫脲

1-(1,3-Benzothia-zol-2-yl)-3-benzoyl-thio-urea.

作者信息

Yunus Uzma, Tahir Muhammad Kalim, Bhatti Moazzam Hussain, Ali Saqib, Wong Wai-Yeung

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2007 Dec 6;64(Pt 1):o20. doi: 10.1107/S160053680706134X.

Abstract

The title compound, C(15)H(11)N(3)OS(2), was synthesized from benzoyl thio-cyanate and 2-amino-benzothia-zole in dry acetone. The thio-urea group is in the thio-amide form. The mol-ecules are stabilized by two inter-molecular C-H⋯S and C-H⋯O hydrogen bonds. Intra-molecular N-H⋯O hydrogen bonding results in a pseudo-S(6) planar ring with dihedral angles of 11.23 and 11.91° with the benzothiazole ring system and the phenyl ring, respectively.

摘要

标题化合物C(15)H(11)N(3)OS(2)由苯甲酰硫氰酸盐和2-氨基苯并噻唑在干燥丙酮中合成。硫脲基团呈硫代酰胺形式。分子通过两个分子间C-H⋯S和C-H⋯O氢键得以稳定。分子内N-H⋯O氢键形成一个假S(6)平面环,与苯并噻唑环系和苯环的二面角分别为11.23°和11.91°。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6858/2914982/a64a10c7adc4/e-64-00o20-fig1.jpg

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