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(E)-2-Bromo-4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino-meth-yl]-6-meth-oxy-phenyl 4-methyl-benzene-sulfonate.

ABSTRACT: In the title compound, C(26)H(24)BrN(3)O(5)S, the central benzene ring makes dihedral angles of 6.27?(6), 33.63?(6) and 69.31?(5)°, respectively, with the pyrazolone ring, the bromo-benzene ring and the terminal phenyl ring. An intra-molecular C-H?O hydrogen bond occurs. The crystal packing features weak non-classical C-Br?O inter-actions [Br?O = 3.222?(2)?Å] that form inversion-related dimers.

SUBMITTER: Duan ZY

PROVIDER: S-EPMC3344472 | biostudies-other | 2012 May

REPOSITORIES: biostudies-other

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(E)-2-Bromo-4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino-meth-yl]-6-meth-oxy-phenyl 4-methyl-benzene-sulfonate.

Duan Zhong-Yu ZY Yang Lin L Yang Li-Ping LP Liu Xiu-Wu XW

Acta crystallographica. Section E, Structure reports online 20120406 Pt 5

In the title compound, C(26)H(24)BrN(3)O(5)S, the central benzene ring makes dihedral angles of 6.27 (6), 33.63 (6) and 69.31 (5)°, respectively, with the pyrazolone ring, the bromo-benzene ring and the terminal phenyl ring. An intra-molecular C-H⋯O hydrogen bond occurs. The crystal packing features weak non-classical C-Br⋯O inter-actions [Br⋯O = 3.222 (2) Å] that form inversion-related dimers. ...[more]

PMID: 22590234

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