1-(4-fluorophenyl)-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(4-fluorophenyl)-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(4-fluorophenyl)-6-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(4-fluorophenyl)-6-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(4-fluorophenyl)-6-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(4-fluorophenyl)-6-[(2-keto-2-pyrrolidino-ethyl)thio]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H16FN5O2S MolecularWeight: 373.404643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)F

InChI

InChI=1S/C17H16FN5O2S/c18-11-3-5-12(6-4-11)23-15-13(9-19-23)16(25)21-17(20-15)26-10-14(24)22-7-1-2-8-22/h3-6,9,19H,1-2,7-8,10H2