Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation
. 2008 Oct 9;64(Pt 11):o2083.
doi: 10.1107/S1600536808030596.

Propyl 2-(3-benzoyl-thio-ureido)acetate

Affiliations

Propyl 2-(3-benzoyl-thio-ureido)acetate

Ibrahim N Hassan et al. Acta Crystallogr Sect E Struct Rep Online. .

Abstract

The title compound, C(13)H(16)N(2)O(3)S, is a thio-urea derivative with benzoyl and propoxycarbonyl-methyl groups attached to the two terminal N atoms. These groups adopt trans and cis configurations, respectively, with respect to the S atom across the thio-urea C-N bonds. The compound crystallizes in the P2(1)/c space group with Z = 8, resulting in two unique molecules in the asymmetric unit linked by C-H⋯S and C-H⋯O hydrogen bonds, forming a one-dimensional zigzag chain along the c axis.

PubMed Disclaimer

Figures

Fig. 1.
Fig. 1.
The molecular structure of (I), with displacement ellipsods are drawn at the 50% probability level.
Fig. 2.
Fig. 2.
Crystal packing of (I) viewed down the a axis. Hydrogen bonds are drawn as dashed lines.

References

    1. Allen, F. H., Kennard, O., Watson, D. G., Brammer, L., Orpen, A. G. & Taylor, R. (1987). J. Chem. Soc. Perkin Trans. 2, pp. S1–19.
    1. Bruker (2000). SADABS, SMART and SAINT Bruker AXS Inc., Madison, Wisconsin, USA.
    1. Hassan, I. N., Yamin, B. M. & Kassim, M. B. (2008). Acta Cryst. E64, o1727. - PMC - PubMed
    1. Nardelli, M. (1995). J. Appl. Cryst.28, 659.
    1. Sheldrick, G. M. (2008). Acta Cryst. A64, 112–122. - PubMed