Table 4. Experimental details.

Crystal data
Chemical formula	C11H15N3S
M r	221.32
Crystal system, space group	Monoclinic, P21/c
Temperature (K)	100
a, b, c ()	13.7289(13), 7.4341(7), 11.5757(11)
()	102.690(1)
V (3)	1152.58(19)
Z	4
Radiation type	Mo K
(mm1)	0.25
Crystal size (mm)	0.12 0.05 0.03
Data collection
Diffractometer	Bruker SMART APEX CCD
Absorption correction	Multi-scan (SADABS; Sheldrick, 1996 ▸)
T min, T max	0.970, 0.993
No. of measured, independent and observed [I > 2(I)] reflections	10739, 2646, 2052
R int	0.050
(sin /)max (1)	0.650
Refinement
R[F 2 > 2(F 2)], wR(F 2), S	0.041, 0.098, 1.02
No. of reflections	2646
No. of parameters	147
No. of restraints	2
H-atom treatment	H atoms treated by a mixture of independent and constrained refinement
max, min (e 3)	0.27, 0.27

Computer programs: APEX2 and SAINT (Bruker, 2008 ▸), SHELXS97 (Sheldrick, 2008 ▸), SHELXL2014/7 (Sheldrick, 2015 ▸), ORTEP-3 for Windows (Farrugia, 2012 ▸), QMol (Gans Shalloway, 2001 ▸), DIAMOND (Brandenburg, 2006 ▸) and publCIF (Westrip, 2010 ▸).