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1-(4-Bromo-phen-yl)-2-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)meth-yl]-4-phenyl-4H-1,2,4-triazol-3-ylsulfan-yl}ethanone.

ABSTRACT: The title compound, C(22)H(20)BrN(5)OS, is a potent new fungicide. The planes of the phenyl and pyrozole rings are almost perpendicular, making a dihedral angle of 86.5?(4)°. There are two non-classical inter-molecular C-H?O and C-H?N hydrogen bonds in the crystal structure.

SUBMITTER: Xiao SM

PROVIDER: S-EPMC2968199 | biostudies-literature | 2009 Jan

REPOSITORIES: biostudies-literature

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1-(4-Bromo-phen-yl)-2-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)meth-yl]-4-phenyl-4H-1,2,4-triazol-3-ylsulfan-yl}ethanone.

Xiao Shan-Mei SM

Acta crystallographica. Section E, Structure reports online 20090110 Pt 2

The title compound, C(22)H(20)BrN(5)OS, is a potent new fungicide. The planes of the phenyl and pyrozole rings are almost perpendicular, making a dihedral angle of 86.5 (4)°. There are two non-classical inter-molecular C-H⋯O and C-H⋯N hydrogen bonds in the crystal structure. ...[more]

PMID: 21581887

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