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

Systemtic Name: 1-[4-azanyl-5-(4-methylphenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one Openeye Name: 1-[4-amino-5-(p-tolyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one CAS Name: 1-[4-amino-5-(4-methylphenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]-1-butanone IUPAC Name: 1-[4-amino-5-(4-methylphenyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one Traditional Name: 1-[4-amino-5-(p-tolyl)-6H-pyrazolo[3,4-d]pyrimidin-7-yl]butan-1-one Formula: C16H19N5O MolecularWeight: 297.35496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5O/c1-3-4-14(22)21-10-20(12-7-5-11(2)6-8-12)15(17)13-9-18-19-16(13)21/h5-9H,3-4,10,17H2,1-2H3