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

Systemtic Name: 6-ethanoyl-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-acetyl-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 6-acetyl-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-acetyl-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-acetyl-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN=C2C(=CNN2C1=O)C3=CC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CN=C2C(=CNN2C1=O)C3=CC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C20H15N3O2S/c1-13(24)17-11-21-19-18(12-22-23(19)20(17)25)14-7-9-16(10-8-14)26-15-5-3-2-4-6-15/h2-12,22H,1H3