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

Systemtic Name: 3-(4-phenylsulfanylphenyl)-5-(pyridin-3-yloxymethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3-(4-phenylsulfanylphenyl)-5-(3-pyridyloxymethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-[4-(phenylthio)phenyl]-5-(3-pyridinyloxymethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 3-(4-phenylsulfanylphenyl)-5-(pyridin-3-yloxymethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 3-[4-(phenylthio)phenyl]-5-(3-pyridyloxymethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C24H18N4O2S MolecularWeight: 426.49032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC(=CC4=O)COC5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC(=CC4=O)COC5=CN=CC=C5

InChI

InChI=1S/C24H18N4O2S/c29-23-13-18(16-30-19-5-4-12-25-14-19)27-24-22(15-26-28(23)24)17-8-10-21(11-9-17)31-20-6-2-1-3-7-20/h1-15,26H,16H2