The title compound, C 17 H 12 ClN 5 S, has been synthesized as a potent anticancer agent. The dihedral angle between the thiazole and triazole rings is 85.9 (2) . There are intermolecular N-HÁ Á ÁN and C-HÁ Á ÁCl interactions in the crystal structure.
(E)-4-(4-Chlorophenyl)-N-(5-methyl-1,3-benzodioxol-5-ylmethylene)-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazol-2-amine
✍ Scribed by Shao, Ling ;Zhang, Qing ;Zhou, Xin ;Fang, Jian-Xin
- Publisher
- International Union of Crystallography
- Year
- 2005
- Tongue
- English
- Weight
- 182 KB
- Volume
- 62
- Category
- Article
- ISSN
- 1600-5368
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📜 SIMILAR VOLUMES
In the title compound, C 16 H 13 Cl 3 N 6 O 3 S, the substituted triazole ring is bound via a methylene bridge to a chlorothiazole unit. There is evidence for significant electron delocalization in the triazolyl system. Both intra-and intermolecular hydrogen bonds are found in the structure.
Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.003 A Ê R factor = 0.040 wR factor = 0.116 Data-to-parameter ratio = 15.4 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
The title compound, [Fe(C 5 H 5 )(C 17 H 11 N 6 O 3 S)], has been synthesized as a potential anticancer agent. There are two molecules in the asymmetric unit. In the crystal structure, the molecules are associated via N-HÁ Á ÁN and C-HÁ Á ÁO interactions.