1-[4-azanyl-5-(4-fluorophenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one

Systemtic Name: 1-[4-azanyl-5-(4-fluorophenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one Openeye Name: 1-[4-amino-5-(4-fluorophenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one CAS Name: 1-[4-amino-5-(4-fluorophenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]-1-butanone IUPAC Name: 1-[4-amino-5-(4-fluorophenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one Traditional Name: 1-[4-amino-5-(4-fluorophenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one Formula: C15H16FN5O MolecularWeight: 301.318843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CN(C(=C2C1=NN=C2)N)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC(=O)N1CN(C(=C2C1=NN=C2)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C15H16FN5O/c1-2-3-13(22)21-9-20(11-6-4-10(16)5-7-11)14(17)12-8-18-19-15(12)21/h4-8H,2-3,9,17H2,1H3