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3-Benzyl-6-butyl-5-propyl-3H-1,2,3-triazolo[4,5-d]pyrimidin-7(6H)-one.

ABSTRACT: In the title compound, C(18)H(23)N(5)O(2), the triazolopyrimidine ring system is essentially planar, with a maximum displacement of 0.032?(2)?Å, and forms a dihedral angle of 87.59?(15)° with the phenyl ring. In the crystal, mol-ecules are linked by inter-molecular C-H?O hydrogen bonds and C-H?? inter-actions into chains parallel to the c axis.

SUBMITTER: Zeng XH

PROVIDER: S-EPMC3011388 | biostudies-other | 2010 Nov

REPOSITORIES: biostudies-other

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3-Benzyl-6-butyl-5-propyl-3H-1,2,3-triazolo[4,5-d]pyrimidin-7(6H)-one.

Zeng Xiao-Hua XH Deng Shou-Heng SH Wang Hong-Mei HM Zheng Ai-Hua AH Chen Ping P

Acta crystallographica. Section E, Structure reports online 20101113 Pt 12

In the title compound, C(18)H(23)N(5)O(2), the triazolopyrimidine ring system is essentially planar, with a maximum displacement of 0.032 (2) Å, and forms a dihedral angle of 87.59 (15)° with the phenyl ring. In the crystal, mol-ecules are linked by inter-molecular C-H⋯O hydrogen bonds and C-H⋯π inter-actions into chains parallel to the c axis. ...[more]

PMID: 21589440

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