1-(3-chlorophenyl)-6-(1-phenylethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(3-chlorophenyl)-6-(1-phenylethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(3-chlorophenyl)-6-(1-phenylethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(3-chlorophenyl)-6-(1-phenylethylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(3-chlorophenyl)-6-(1-phenylethylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(3-chlorophenyl)-6-(1-phenylethylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H15ClN4OS MolecularWeight: 382.8666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC(=O)C3=CNN(C3=N2)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=NC(=O)C3=CNN(C3=N2)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H15ClN4OS/c1-12(13-6-3-2-4-7-13)26-19-22-17-16(18(25)23-19)11-21-24(17)15-9-5-8-14(20)10-15/h2-12,21H,1H3