Abstract
In the title compound, C14H13N5OS, the dihedral angle between the fused ring system (r.m.s. deviation = 0.028 Å) and the phenyl ring is 48.24 (4)°. The molecule features both an intramolecular N—H⋯O and an N—H⋯N hydrogen bond. In the crystal, molecules are linked by N—H⋯O and N—H⋯N hydrogen bonds, generating a three-dimensional network. A weak N—H⋯π interaction is also observed.
Highlights
In the title compound, C14H13N5OS, the dihedral angle between the fused ring system (r.m.s. deviation = 0.028 A ) and the phenyl ring is 48.24 (4)
Molecules are linked by N—HÁ Á ÁO and N—HÁ Á ÁN hydrogen bonds, generating a three-dimensional network
Cg3 is the centroid of the C9–C14 phenyl ring
Summary
Key indicators: single-crystal X-ray study; T = 150 K; mean (C–C) = 0.002 A; R factor = 0.037; wR factor = 0.101; data-to-parameter ratio = 18.4. C14H13N5OS, the dihedral angle between the fused ring system (r.m.s. deviation = 0.028 A ) and the phenyl ring is 48.24 (4). The molecule features both an intramolecular N—HÁ Á ÁO and an N—HÁ Á ÁN hydrogen bond. Molecules are linked by N—HÁ Á ÁO and N—HÁ Á ÁN hydrogen bonds, generating a three-dimensional network. Related literature For background to thienopyridine-containing compounds, see: Boschelli et al (2008); Bakhite et al (2002); Schnute et al (2007)
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