3-[1-(4-fluorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]propanenitrile

Systemtic Name: 3-[1-(4-fluorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]propanenitrile Openeye Name: 3-[1-(4-fluorophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]propanenitrile CAS Name: 3-[1-(4-fluorophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]propanenitrile IUPAC Name: 3-[1-(4-fluorophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]propanenitrile Traditional Name: 3-[1-(4-fluorophenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]propionitrile Formula: C14H10FN5O MolecularWeight: 283.260503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)CCC#N)F

Isomeric SMILES

C1=CC(=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)CCC#N)F

InChI

InChI=1S/C14H10FN5O/c15-10-2-4-11(5-3-10)20-13-12(8-18-20)14(21)19(9-17-13)7-1-6-16/h2-5,8-9H,1,7H2