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Ethyl 2-benzyl-sulfanyl-7-(2-chloro-phen-yl)-5-methyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxyl-ate.


ABSTRACT: In the title compound, C(22)H(21)ClN(4)O(2)S, the bicyclic triazolopyrimidine ring system is nearly planar, and oriented at dihedral angles of 89.45?(3)° with respect to the chlorobenzene ring and 87.03?(3)° with respect to the terminal phenyl ring. In the crystal structure, mol-ecules are linked by ?-? stacking inter-actions between the triazolopyrimidine rings [centroid-centroid distances of 3.88?(1) and 3.63?(1)?Å].

SUBMITTER: Song DD 

PROVIDER: S-EPMC2915002 | biostudies-literature | 2007 Dec

REPOSITORIES: biostudies-literature

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Ethyl 2-benzyl-sulfanyl-7-(2-chloro-phen-yl)-5-methyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxyl-ate.

Song Dan-Dan DD   Chen Qiong Q  

Acta crystallographica. Section E, Structure reports online 20071206 Pt 1


In the title compound, C(22)H(21)ClN(4)O(2)S, the bicyclic triazolopyrimidine ring system is nearly planar, and oriented at dihedral angles of 89.45 (3)° with respect to the chlorobenzene ring and 87.03 (3)° with respect to the terminal phenyl ring. In the crystal structure, mol-ecules are linked by π-π stacking inter-actions between the triazolopyrimidine rings [centroid-centroid distances of 3.88 (1) and 3.63 (1) Å]. ...[more]

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