6-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-(4-methylphenoxy)ethylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[2-(4-methylphenoxy)ethylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-14-7-9-16(10-8-14)26-11-12-27-20-22-18-17(19(25)23-20)13-21-24(18)15-5-3-2-4-6-15/h2-10,13,21H,11-12H2,1H3