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
. 2012 Feb 1;68(Pt 2):o395.
doi: 10.1107/S1600536812000621. Epub 2012 Jan 14.

1-Benzoyl-2-thio-biuret

Sung Kwon Kang  1 , Nam Sook Cho, Min Kyeong Jeon
Affiliations

1-Benzoyl-2-thio-biuret

Sung Kwon Kang et al. Acta Crystallogr Sect E Struct Rep Online. .

Abstract

IN THE TITLE COMPOUND [SYSTEMATIC NAME: N-(carbamoyl-carb-a-mo-thio-yl)benzamide], C(9)H(9)N(3)O(2)S, the benzoyl and terminal urea fragments adopt cisoid and transoid conformations, respectively, with respect to the S atom. The benzoyl and thio-biuret groups are almost coplanar, making a dihedral angle of 8.48 (5)°. The mol-ecular structure is stabilized by an intra-molecular N-H⋯O hydrogen bond. In the crystal, N-H⋯O and N-H⋯S hydrogen bonds link the mol-ecules into a sheet parallel to the bc plane.

PubMed Disclaimer

Figures

Fig. 1.
Fig. 1.
Molecular structure of the title compound, showing the atom-numbering scheme and 30% probability ellipsoids. Intramolecular N—H···O hydrogen bond is indicated by a dashed line.
Fig. 2.
Fig. 2.
Part of the packing diagram of the title compound, showing a molecular sheet formed by intermolecular N—H···O and N—H···S hydrogen bonds (dashed lines).
See this image and copyright information in PMC

References

    1. Bruker (2002). SADABS, SAINT and SMART Bruker AXS Inc., Madison, Wisconsin, USA.
    1. Castro, A., Encinas, A., Gil, C., Brase, S., Porcal, W., Perez, C., Moreno, F. J. & Martinez, A. (2008). Bioorg. Med. Chem. 16, 495–510. - PubMed
    1. Cho, N. S., Ra, C. S., Ra, D. Y., Song, J. S. & Kang, S. K. (1996). J. Heterocycl. Chem. 33, 1201–1206.
    1. Cho, N. S., Shon, H. I. & Parkanyi, C. (1991a). J. Heterocycl. Chem. 28, 1645–1649.
    1. Cho, N. S., Shon, H. I. & Parkanyi, C. (1991b). J. Heterocycl. Chem. 28, 1725–1729.