3-(3,5-dimethoxy-4-phenylsulfanyl-phenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 3-(3,5-dimethoxy-4-phenylsulfanyl-phenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3-(3,5-dimethoxy-4-phenylsulfanyl-phenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-[3,5-dimethoxy-4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 3-(3,5-dimethoxy-4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 3-[3,5-dimethoxy-4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1SC2=CC=CC=C2)OC)C3=CNN4C3=NC=CC4=O

Isomeric SMILES

COC1=CC(=CC(=C1SC2=CC=CC=C2)OC)C3=CNN4C3=NC=CC4=O

InChI

InChI=1S/C20H17N3O3S/c1-25-16-10-13(15-12-22-23-18(24)8-9-21-20(15)23)11-17(26-2)19(16)27-14-6-4-3-5-7-14/h3-12,22H,1-2H3