• 
  [Synonyms]
  NCI60_018207
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	349.4063 [g/mol]
  Molecular Formula	C19H15N3O2S
  XLogP	2.9
  H-Bond Donor	1
  H-Bond Acceptor	4
  Rotatable Bond Count	4
  Exact Mass	349.088497
  MonoIsotopic Mass	349.088497
  Topological Polar Surface Area	67.3
  Heavy Atom Count	25
  Formal Charge	0
  Complexity	569
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	0
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	1
  Covalently-Bonded Unit Count	1

  
  [ Descriptors Computed from Structure]
  IUPAC Name: 2-[1-(1H-benzimidazol-2-yl)-2-(4-methoxyphenyl)ethenyl]-1,
  3-thiazol-4-one
  Canonical SMILES: COC1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)C4=NC(=O)CS4
  InChI: InChI=1/C19H15N3O2S/c1-24-13-8-6-12(7-9-13)10-14(19-22-17(23)11-25-19)
  18-20-15-4-2-3-5-16(15)21-18/h2-10H,11H2,1H3,(H,20,21)/f/h20H