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Home> Encyclopedia > Hot Product Listed M   > MCULE-6386649313
866018-47-5 structure

MCULE-6386649313

Iupac Name:8-phenoxy-4-(2-phenylethenyl)-2,3-dihydrothieno[3,2-c]quinoline
CAS No.:866018-47-5
Molecular Weight:381.493
Molecular Formula:C25H19NOS (isomer)
Names and Identifiers
Synonyms

8-phenoxy-4-(2-phenylethenyl)-2,3-dihydrothieno[3,2-c]quinoline AC1MZHY1 KS-000038LO

Inchi
InChI=1S/C25H19NOS/c1-3-7-18(8-4-1)11-13-23-21-15-16-28-25(21)22-17-20(12-14-24(22)26-23)27-19-9-5-2-6-10-19/h1-14,17H,15-16H2
InChkey
FPHKEQMADXPAAB-UHFFFAOYSA-N
Canonical Smiles
C1CSC2=C1C(=NC3=C2C=C(C=C3)OC4=CC=CC=C4)C=CC5=CC=CC=C5
Computational chemical data
  • Molecular Weight:381.493g/mol
  • Molecular Formula:C25H19NOS
  • Compound Is Canonicalized:True
  • Exact Mass:381.119
  • Monoisotopic Mass:381.119
  • Complexity:525
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Heavy Atom Count:28
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:1
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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