Mohamed-Ezzat Reham A, Elgemeie Galal H, Jones Peter G
Chemistry of Natural and Microbial Products Department, Pharmaceutical and Drug Industries Research Institute, National Research Centre, Cairo, Egypt.
Chemistry Department, Faculty of Science, Helwan University, Cairo, Egypt.
IUCrdata. 2025 Jun 24;10(Pt 6):x250544. doi: 10.1107/S2414314625005449. eCollection 2025 Jun.
In the structure of the title compound, CHNOS, the bond lengths in the C-S-C moiety are almost equal at 1.7959 (8) and 1.7877 (9) Å, with a shorter formally double C-S bond of 1.6698 (9) Å at the other sulfur atom. The eight-atom sequence O3-C3-C2-C1-S-C-N-C (using standard sugar numbering) shows an extended conformation. The packing involves 'weak' hydrogen bonds, whereby the three shortest C-H⋯O contacts combine to form layers of mol-ecules parallel to the plane.
在标题化合物CHNOS的结构中,C-S-C部分的键长几乎相等,分别为1.7959 (8) Å和1.7877 (9) Å,而在另一个硫原子处,形式上的双键C-S键较短,为1.6698 (9) Å。八原子序列O3-C3-C2-C1-S-C-N-C(采用标准糖编号)呈伸展构象。堆积涉及“弱”氢键,其中三个最短的C-H⋯O接触相结合,形成与 平面平行的分子层。