5-[2-(2-fluorophenyl)sulfanylethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-(2-fluorophenyl)sulfanylethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-(2-fluorophenyl)sulfanylethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-[(2-fluorophenyl)thio]ethyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-(2-fluorophenyl)sulfanylethyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-[(2-fluorophenyl)thio]ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H15FN4OS MolecularWeight: 366.412003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CCSC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CCSC4=CC=CC=C4F

InChI

InChI=1S/C19H15FN4OS/c20-16-8-4-5-9-17(16)26-11-10-23-13-21-18-15(19(23)25)12-22-24(18)14-6-2-1-3-7-14/h1-9,12-13H,10-11H2