4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate

4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate

In the title compound, C16H17N3O2S·H2O, the triazole ring makes a dihedral angle of 34.63 (6)° with the benzene ring. The thiophene ring is disordered over two orientations [occupancy ratio = 0.634 (4):0.366 (4)] which make dihedral...

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Main Authors: Anuradha Gurumoorthy, Vasuki Gopalsamy, K. Ramamurthi, Dilek Ünlüer, Fatih Çelik
Format: Article
Language:English
Published: International Union of Crystallography 2011-12-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811045508
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spelling doaj-d61ab3f3ecdc41cfbe0c009ba11749c52020-11-25T00:59:44ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-12-016712o3188o318910.1107/S16005368110455084-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrateAnuradha GurumoorthyVasuki GopalsamyK. RamamurthiDilek ÜnlüerFatih ÇelikIn the title compound, C16H17N3O2S·H2O, the triazole ring makes a dihedral angle of 34.63 (6)° with the benzene ring. The thiophene ring is disordered over two orientations [occupancy ratio = 0.634 (4):0.366 (4)] which make dihedral angles of 54.61 (16) and 54.57 (31)° with the triazole ring. Intermolecular N—H...O and O—H...O hydrogen bonds stabilize the crystal structure.http://scripts.iucr.org/cgi-bin/paper?S1600536811045508
collection DOAJ
language English
format Article
sources DOAJ
author Anuradha Gurumoorthy
Vasuki Gopalsamy
K. Ramamurthi
Dilek Ünlüer
Fatih Çelik
spellingShingle Anuradha Gurumoorthy
Vasuki Gopalsamy
K. Ramamurthi
Dilek Ünlüer
Fatih Çelik
4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate
Acta Crystallographica Section E
author_facet Anuradha Gurumoorthy
Vasuki Gopalsamy
K. Ramamurthi
Dilek Ünlüer
Fatih Çelik
author_sort Anuradha Gurumoorthy
title 4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate
title_short 4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate
title_full 4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate
title_fullStr 4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate
title_full_unstemmed 4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate
title_sort 4-[2-(4-methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1h-1,2,4-triazol-5(4h)-one monohydrate
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2011-12-01
description In the title compound, C16H17N3O2S·H2O, the triazole ring makes a dihedral angle of 34.63 (6)° with the benzene ring. The thiophene ring is disordered over two orientations [occupancy ratio = 0.634 (4):0.366 (4)] which make dihedral angles of 54.61 (16) and 54.57 (31)° with the triazole ring. Intermolecular N—H...O and O—H...O hydrogen bonds stabilize the crystal structure.
url http://scripts.iucr.org/cgi-bin/paper?S1600536811045508
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AT vasukigopalsamy 424methoxyphenylethyl3thiophen2ylmethyl1h124triazol54honemonohydrate
AT kramamurthi 424methoxyphenylethyl3thiophen2ylmethyl1h124triazol54honemonohydrate
AT dilekamp220nlamp252er 424methoxyphenylethyl3thiophen2ylmethyl1h124triazol54honemonohydrate
AT fatihamp199elik 424methoxyphenylethyl3thiophen2ylmethyl1h124triazol54honemonohydrate
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