3-(4-phenylsulfanylphenyl)-5-(2-pyridin-2-ylsulfanylethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 3-(4-phenylsulfanylphenyl)-5-(2-pyridin-2-ylsulfanylethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3-(4-phenylsulfanylphenyl)-5-[2-(2-pyridylsulfanyl)ethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-[4-(phenylthio)phenyl]-5-[2-(2-pyridinylthio)ethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 3-(4-phenylsulfanylphenyl)-5-(2-pyridin-2-ylsulfanylethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 3-[4-(phenylthio)phenyl]-5-[2-(2-pyridylthio)ethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C25H20N4OS2 MolecularWeight: 456.5825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC(=CC4=O)CCSC5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC(=CC4=O)CCSC5=CC=CC=N5

InChI

InChI=1S/C25H20N4OS2/c30-24-16-19(13-15-31-23-8-4-5-14-26-23)28-25-22(17-27-29(24)25)18-9-11-21(12-10-18)32-20-6-2-1-3-7-20/h1-12,14,16-17,27H,13,15H2