Author:
Kalashetti Mallikarjun B.,Fathima Nikhath,Khan Ashraf Y.,Begum Noor Shahina,Khazi I. M.
Abstract
In the title compound, C12H16N4S, the fused benzothiophene and the pyrimidine rings are coplanar [dihedral angle = 1.61 (6)°]. Three C atoms of the cyclohexene ring (at positions 3, 6 and 7) are disordered over two sites with an occupancy ratio of 0.702 (8):0.298 (8). The cyclohexene ring in both the major and minor components adopts a half-chair conformation. The crystal structure is stabilized by N—H...N and C—H...N interactions, resulting in the formation of inversion dimers withR22(10) andR22(12) graph-set motifs.
Publisher
International Union of Crystallography (IUCr)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
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