Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate

The asymmetric unit of the title compound, C17H17N3O2S, consists of two independent molecules, A and B, with different conformations: in molecule A, the dihedral angles between the central benzene ring and the pendant tolyl and carbamothioylhydrazono groups are 71.12 (9) and 5.95 (8)°, respectively....

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Main Authors:	Karthik Ananth Mani, Vijayan Viswanathan, S. Narasimhan, Devadasan Velmurugan
Format:	Article
Language:	English
Published:	International Union of Crystallography 2015-01-01
Series:	Acta Crystallographica Section E: Crystallographic Communications
Subjects:	crystal structure thiosemicarbazones derivatives biological activity hydrogen bonding ester
Online Access:	http://scripts.iucr.org/cgi-bin/paper?S2056989014026942

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record_format	Article
spelling	doaj-cede0578cbfa4e9e9f6d3f2e8b94496b2020-11-24T22:23:14ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902015-01-01711o43o4410.1107/S2056989014026942hb7334Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoateKarthik Ananth Mani0Vijayan Viswanathan1S. Narasimhan2Devadasan Velmurugan3Department of Chemistry, Asthagiri Herbal Research Foundation, Perungudi Industrial Estate, Perungudi, Chennai 600 096, IndiaCentre of Advanced Study in Crystallography and Biophysics, University of Madras, Guindy Campus, Chennai 600 025, IndiaDepartment of Chemistry, Asthagiri Herbal Research Foundation, Perungudi Industrial Estate, Perungudi, Chennai 600 096, IndiaCentre of Advanced Study in Crystallography and Biophysics, University of Madras, Guindy Campus, Chennai 600 025, IndiaThe asymmetric unit of the title compound, C17H17N3O2S, consists of two independent molecules, A and B, with different conformations: in molecule A, the dihedral angles between the central benzene ring and the pendant tolyl and carbamothioylhydrazono groups are 71.12 (9) and 5.95 (8)°, respectively. The corresponding angles in molecule B are 50.56 (12) and 26.43 (11)°, respectively. Both molecules feature an intramolecular N—H...N hydrogen bond, which closes an S(5) ring. In the crystal, molecules are linked by N—H...O, N—H...S and C—H...O hydrogen bonds, generating a three-dimensional network.http://scripts.iucr.org/cgi-bin/paper?S2056989014026942crystal structurethiosemicarbazones derivativesbiological activityhydrogen bondingester
collection	DOAJ
language	English
format	Article
sources	DOAJ
author	Karthik Ananth Mani Vijayan Viswanathan S. Narasimhan Devadasan Velmurugan
spellingShingle	Karthik Ananth Mani Vijayan Viswanathan S. Narasimhan Devadasan Velmurugan Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate Acta Crystallographica Section E: Crystallographic Communications crystal structure thiosemicarbazones derivatives biological activity hydrogen bonding ester
author_facet	Karthik Ananth Mani Vijayan Viswanathan S. Narasimhan Devadasan Velmurugan
author_sort	Karthik Ananth Mani
title	Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate
title_short	Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate
title_full	Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate
title_fullStr	Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate
title_full_unstemmed	Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate
title_sort	crystal structure of (e)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate
publisher	International Union of Crystallography
series	Acta Crystallographica Section E: Crystallographic Communications
issn	2056-9890
publishDate	2015-01-01
description	The asymmetric unit of the title compound, C17H17N3O2S, consists of two independent molecules, A and B, with different conformations: in molecule A, the dihedral angles between the central benzene ring and the pendant tolyl and carbamothioylhydrazono groups are 71.12 (9) and 5.95 (8)°, respectively. The corresponding angles in molecule B are 50.56 (12) and 26.43 (11)°, respectively. Both molecules feature an intramolecular N—H...N hydrogen bond, which closes an S(5) ring. In the crystal, molecules are linked by N—H...O, N—H...S and C—H...O hydrogen bonds, generating a three-dimensional network.
topic	crystal structure thiosemicarbazones derivatives biological activity hydrogen bonding ester
url	http://scripts.iucr.org/cgi-bin/paper?S2056989014026942
work_keys_str_mv	AT karthikananthmani crystalstructureofe412carbamothioylhydrazin1ylideneethylphenyl4methylbenzoate AT vijayanviswanathan crystalstructureofe412carbamothioylhydrazin1ylideneethylphenyl4methylbenzoate AT snarasimhan crystalstructureofe412carbamothioylhydrazin1ylideneethylphenyl4methylbenzoate AT devadasanvelmurugan crystalstructureofe412carbamothioylhydrazin1ylideneethylphenyl4methylbenzoate
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Crystal structure of (E)-4-{1-[2-(carbamothioyl)hydrazin-1-ylidene]ethyl}phenyl 4-methylbenzoate

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