5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole

In the title omeprazole derivative, C20H21N3O3S, the benzimidazole ring is inclined to the pyridine ring by 21.21 (8)°. In the crystal, neighbouring molecules are linked by C—H...O hydrogen bonds, forming chains along the a-axis direction. Within the chains, there are offset π–π interactions [interc...

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Main Authors:	Youness El Bakri, Youssef Ramli, Abdallah Harmaoui, Mohamed Elhafi, El Mokhtar Essassi, Joel T. Mague
Format:	Article
Language:	English
Published:	International Union of Crystallography 2016-10-01
Series:	IUCrData
Subjects:	crystal structure omeprazole benzimidazole C—H...O hydrogen bonding offset π–π stacking
Online Access:	http://scripts.iucr.org/cgi-bin/paper?S2414314616016953

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spelling	doaj-dafd2ad83fbd479fa327f45877d0cb772020-11-25T00:28:31ZengInternational Union of CrystallographyIUCrData2414-31462016-10-01110x16169510.1107/S2414314616016953su40875-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazoleYouness El Bakri0Youssef Ramli1Abdallah Harmaoui2Mohamed Elhafi3El Mokhtar Essassi4Joel T. Mague5Laboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av. Ibn Battouta, BP 1014, Faculté des Sciences, Université Mohammed V, Rabat, MoroccoMedicinal Chemistry Laboratory, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, 10170 Rabat, MoroccoLaboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av. Ibn Battouta, BP 1014, Faculté des Sciences, Université Mohammed V, Rabat, MoroccoLaboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av. Ibn Battouta, BP 1014, Faculté des Sciences, Université Mohammed V, Rabat, MoroccoLaboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av. Ibn Battouta, BP 1014, Faculté des Sciences, Université Mohammed V, Rabat, MoroccoDepartment of Chemistry, Tulane University, New Orleans, LA 70118, USAIn the title omeprazole derivative, C20H21N3O3S, the benzimidazole ring is inclined to the pyridine ring by 21.21 (8)°. In the crystal, neighbouring molecules are linked by C—H...O hydrogen bonds, forming chains along the a-axis direction. Within the chains, there are offset π–π interactions [intercentroid distance = 3.880 (2) Å] involving neighbouring benzimidazole rings. There are no other significant intermolecular interactions present.http://scripts.iucr.org/cgi-bin/paper?S2414314616016953crystal structureomeprazolebenzimidazoleC—H...O hydrogen bondingoffset π–π stacking
collection	DOAJ
language	English
format	Article
sources	DOAJ
author	Youness El Bakri Youssef Ramli Abdallah Harmaoui Mohamed Elhafi El Mokhtar Essassi Joel T. Mague
spellingShingle	Youness El Bakri Youssef Ramli Abdallah Harmaoui Mohamed Elhafi El Mokhtar Essassi Joel T. Mague 5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole IUCrData crystal structure omeprazole benzimidazole C—H...O hydrogen bonding offset π–π stacking
author_facet	Youness El Bakri Youssef Ramli Abdallah Harmaoui Mohamed Elhafi El Mokhtar Essassi Joel T. Mague
author_sort	Youness El Bakri
title	5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
title_short	5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
title_full	5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
title_fullStr	5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
title_full_unstemmed	5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole
title_sort	5-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1h-benzimidazole
publisher	International Union of Crystallography
series	IUCrData
issn	2414-3146
publishDate	2016-10-01
description	In the title omeprazole derivative, C20H21N3O3S, the benzimidazole ring is inclined to the pyridine ring by 21.21 (8)°. In the crystal, neighbouring molecules are linked by C—H...O hydrogen bonds, forming chains along the a-axis direction. Within the chains, there are offset π–π interactions [intercentroid distance = 3.880 (2) Å] involving neighbouring benzimidazole rings. There are no other significant intermolecular interactions present.
topic	crystal structure omeprazole benzimidazole C—H...O hydrogen bonding offset π–π stacking
url	http://scripts.iucr.org/cgi-bin/paper?S2414314616016953
work_keys_str_mv	AT younesselbakri 5methoxy24methoxy35dimethylpyridin2ylmethylsulfinyl1prop2yn1yl1hbenzimidazole AT yousseframli 5methoxy24methoxy35dimethylpyridin2ylmethylsulfinyl1prop2yn1yl1hbenzimidazole AT abdallahharmaoui 5methoxy24methoxy35dimethylpyridin2ylmethylsulfinyl1prop2yn1yl1hbenzimidazole AT mohamedelhafi 5methoxy24methoxy35dimethylpyridin2ylmethylsulfinyl1prop2yn1yl1hbenzimidazole AT elmokhtaressassi 5methoxy24methoxy35dimethylpyridin2ylmethylsulfinyl1prop2yn1yl1hbenzimidazole AT joeltmague 5methoxy24methoxy35dimethylpyridin2ylmethylsulfinyl1prop2yn1yl1hbenzimidazole
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5-Methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl)]sulfinyl}-1-(prop-2-yn-1-yl)-1H-benzimidazole

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