Acta Crystallographica Section E

Structure Reports Online

Volume 69, Part 11 (November 2013)

organic compounds

Acta Cryst. (2013). E69, o1598    [ doi:10.1107/S1600536813026500 ]

3-Isopropyl-1-{2-[(1-methyl-1H-tetra­zol-5-yl)sulfan­yl]acet­yl}-2,6-di­phenyl­piperidin-4-one hemihydrate

S. Ganesan, P. Sugumar, S. Ananthan and M. N. Ponnuswamy

Abstract: In the title compound, C24H27N5O2S·0.5H2O, the piperidine ring adopts a distorted boat conformation. The phenyl rings subtend dihedral angles of 69.7 (1) and 88.7 (1)° with the best plane through the piperidine moiety. In the crystal, symmetry-related mol­ecules are linked through a network of C-H...O and C-H...N inter­actions, the former connecting them into zigzag chains along the c-axis direction and the latter forming an R22(4)motif. The dimer formation (C-H...N) and the repetition of symmetry-related molecules (C-H...O) along the b-axis direction stabilize the packing mode. The water mol­ecule is located on a twofold rotation axis.

CCDC reference: 963167

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