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

Systemtic Name: 7-oxidanyl-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-5-one Openeye Name: 7-hydroxy-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-5-one CAS Name: 7-hydroxy-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-5-one IUPAC Name: 7-hydroxy-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-5-one Traditional Name: 7-hydroxy-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-5-one Formula: C18H13N3O2S MolecularWeight: 335.37972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC(=O)C=C4O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC(=O)C=C4O

InChI

InChI=1S/C18H13N3O2S/c22-16-10-17(23)21-18(20-16)15(11-19-21)12-6-8-14(9-7-12)24-13-4-2-1-3-5-13/h1-11,19,23H