Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate
The title compound, C16H17NO5S, was one of two condensation products from the reaction of 1-(1,3-benzothiazol-2-yl)propan-2-one with methyl chloroacetate. The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar. The maximum deviations from the l...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2008-12-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536808035782 |
| _version_ | 1818975531664670720 |
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| author | Maher Izaaryene Hans Reuter El Mokhtar Essassi Moussa Salem Yamna Baryala |
| author_facet | Maher Izaaryene Hans Reuter El Mokhtar Essassi Moussa Salem Yamna Baryala |
| author_sort | Maher Izaaryene |
| collection | DOAJ |
| description | The title compound, C16H17NO5S, was one of two condensation products from the reaction of 1-(1,3-benzothiazol-2-yl)propan-2-one with methyl chloroacetate. The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar. The maximum deviations from the least-squares planes are 0.015 (2) and 0.020 (2) Å for the methyl C atoms in the methyl acetate substituents and 0.033 (1) Å for the linked C atom of the benzothiazole substituent. The S, C and N atoms in the thiazole ring of the benzothiazole substituent lie −0.037 (2), 0.046 (2) and −0.028 (2) Å, respectively, from the mean plane defined by the benzene ring atoms. |
| first_indexed | 2024-12-20T15:57:26Z |
| format | Article |
| id | doaj.art-6304a7396c3147429763950c1434ece7 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-20T15:57:26Z |
| publishDate | 2008-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-6304a7396c3147429763950c1434ece72022-12-21T19:34:25ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682008-12-016412o2290o229010.1107/S1600536808035782Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioateMaher IzaaryeneHans ReuterEl Mokhtar EssassiMoussa SalemYamna BaryalaThe title compound, C16H17NO5S, was one of two condensation products from the reaction of 1-(1,3-benzothiazol-2-yl)propan-2-one with methyl chloroacetate. The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar. The maximum deviations from the least-squares planes are 0.015 (2) and 0.020 (2) Å for the methyl C atoms in the methyl acetate substituents and 0.033 (1) Å for the linked C atom of the benzothiazole substituent. The S, C and N atoms in the thiazole ring of the benzothiazole substituent lie −0.037 (2), 0.046 (2) and −0.028 (2) Å, respectively, from the mean plane defined by the benzene ring atoms.http://scripts.iucr.org/cgi-bin/paper?S1600536808035782 |
| spellingShingle | Maher Izaaryene Hans Reuter El Mokhtar Essassi Moussa Salem Yamna Baryala Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate Acta Crystallographica Section E |
| title | Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate |
| title_full | Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate |
| title_fullStr | Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate |
| title_full_unstemmed | Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate |
| title_short | Dimethyl 3-acetyl-3-(1,3-benzothiazol-2-yl)pentanedioate |
| title_sort | dimethyl 3 acetyl 3 1 3 benzothiazol 2 yl pentanedioate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536808035782 |
| work_keys_str_mv | AT maherizaaryene dimethyl3acetyl313benzothiazol2ylpentanedioate AT hansreuter dimethyl3acetyl313benzothiazol2ylpentanedioate AT elmokhtaressassi dimethyl3acetyl313benzothiazol2ylpentanedioate AT moussasalem dimethyl3acetyl313benzothiazol2ylpentanedioate AT yamnabaryala dimethyl3acetyl313benzothiazol2ylpentanedioate |