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N'-Benzoyl-N-tert-butyl-2-chloro-N'-{[3-(6-chloro-3-pyrid-ylmethyl)-2-nitrimino-imidazolidin-1-yl]sulfan-yl}benzo-hydrazide.

ABSTRACT: In the title compound, C(27)H(27)Cl(2)N(7)O(4)S, the amide groups bearing the N-S group and the tert-butyl group have s-trans conformations. The steric size of the tert-butyl and [(6-chloro-3-pyrid-yl)meth-yl]imidazolidin-2-yl-idene groups cause the 2-chloro-benzoyl group and the benzyol group to be directed away from one another, forming a dihedral angle of 60.62 (17)°. The central N-N bond adopts a gauche conformation with a C-N-N-C torsion angle of -79.1 (2)°.

SUBMITTER: Shang J

PROVIDER: S-EPMC2969858 | biostudies-literature | 2009 Aug

REPOSITORIES: biostudies-literature

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N'-Benzoyl-N-tert-butyl-2-chloro-N'-{[3-(6-chloro-3-pyrid-ylmethyl)-2-nitrimino-imidazolidin-1-yl]sulfan-yl}benzo-hydrazide.

Shang Jian J Wang Qing-Min QM Huang Run-Qiu RQ Chen Li L Gao Jianhua J

Acta crystallographica. Section E, Structure reports online 20090812 Pt 9

In the title compound, C(27)H(27)Cl(2)N(7)O(4)S, the amide groups bearing the N-S group and the tert-butyl group have s-trans conformations. The steric size of the tert-butyl and [(6-chloro-3-pyrid-yl)meth-yl]imidazolidin-2-yl-idene groups cause the 2-chloro-benzoyl group and the benzyol group to be directed away from one another, forming a dihedral angle of 60.62 (17)°. The central N-N bond adopts a gauche conformation with a C-N-N-C torsion angle of -79.1 (2)°. ...[more]

PMID: 21577543

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