3,6-bis(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 3,6-bis(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3,6-bis(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3,6-bis[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 3,6-bis(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 3,6-bis[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C30H21N3OS2 MolecularWeight: 503.63724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC=C(C4=O)C5=CC=C(C=C5)SC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)C3=CNN4C3=NC=C(C4=O)C5=CC=C(C=C5)SC6=CC=CC=C6

InChI

InChI=1S/C30H21N3OS2/c34-30-28(22-13-17-26(18-14-22)36-24-9-5-2-6-10-24)19-31-29-27(20-32-33(29)30)21-11-15-25(16-12-21)35-23-7-3-1-4-8-23/h1-20,32H