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N-(5-Chloro-3-methyl-1-phenyl-pyrazol-4-ylcarbon-yl)-N'-(2-methoxy-phen-yl)thio-urea.

ABSTRACT: In the title compound, C(19)H(17)ClN(4)O(2)S, the dihedral angle between the pyrazole and phenyl rings is 43.3?(3)°. The bridging unit between the pyrazole and methoxyphenyl rings is planar within 0.0169?Å and makes dihedral angles of 2.3 and 26.4°, respectively, with these two rings. This conformation is influenced by intramolecular N-H?O and N-H?Cl hydrogen bonds. The crystal packing is stabilized by C-H?? inter-actions.

SUBMITTER: Du HT

PROVIDER: S-EPMC2960808 | biostudies-other | 2008

REPOSITORIES: biostudies-other

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N-(5-Chloro-3-methyl-1-phenyl-pyrazol-4-ylcarbon-yl)-N'-(2-methoxy-phen-yl)thio-urea.

Du Hai-Tang HT Du Hai-Jun HJ Lu Ming M Sun Li-Li LL

Acta crystallographica. Section E, Structure reports online 20080220 Pt 3

In the title compound, C(19)H(17)ClN(4)O(2)S, the dihedral angle between the pyrazole and phenyl rings is 43.3 (3)°. The bridging unit between the pyrazole and methoxyphenyl rings is planar within 0.0169 Å and makes dihedral angles of 2.3 and 26.4°, respectively, with these two rings. This conformation is influenced by intramolecular N-H⋯O and N-H⋯Cl hydrogen bonds. The crystal packing is stabilized by C-H⋯π inter-actions. ...[more]

PMID: 21201945

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