Crystallographic and spectroscopic characterization of 2-[(7-acetyl-4-cyano-6-hydroxy-1,6-dimethyl-8-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-phenylacetamide

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Al-Taifi E. A., Maraei I. S., Bakhite E. A., Demirtas G., Mague J. T., Mohamed S. K., ...More

ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, vol.77, pp.121-132, 2021 (ESCI) identifier identifier identifier

  • Publication Type: Article / Article
  • Volume: 77
  • Publication Date: 2021
  • Doi Number: 10.1107/s2056989021000372
  • Journal Name: ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE
  • Journal Indexes: Emerging Sources Citation Index (ESCI), Scopus
  • Page Numbers: pp.121-132
  • Keywords: crystal structure, tetrahydroisoquinoline, phenylacetamide, hydrogen bond, C-H center dot center dot center dot pi(ring) interaction, ANALOGS
  • Ondokuz Mayıs University Affiliated: Yes

Abstract

In the title molecule, C28H27N3O3S, the heterocyclic portion of the tetrahydroisoquinoline unit is planar and an intramolecular N-H center dot center dot center dot N hydrogen bond and a C-H center dot center dot center dot pi(ring) interaction help to determine the overall conformation. In the crystal, a layer structure with the layers parallel to (101) is generated by O-H center dot center dot center dot O and C-H center dot center dot center dot O hydrogen bonds.