2-[3,4-dimethyl-1-(6-methylpyrimidin-4-yl)-6-oxidanylidene-2H-pyrazolo[3,4-b]pyridin-5-yl]ethanoate

Systemtic Name: 2-[3,4-dimethyl-1-(6-methylpyrimidin-4-yl)-6-oxidanylidene-2H-pyrazolo[3,4-b]pyridin-5-yl]ethanoate Openeye Name: 2-[3,4-dimethyl-1-(6-methylpyrimidin-4-yl)-6-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl]acetate CAS Name: 2-[3,4-dimethyl-1-(6-methyl-4-pyrimidinyl)-6-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl]acetate IUPAC Name: 2-[3,4-dimethyl-1-(6-methylpyrimidin-4-yl)-6-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl]acetate Traditional Name: 2-[6-keto-3,4-dimethyl-1-(6-methylpyrimidin-4-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]acetate Formula: C15H14N5O3- MolecularWeight: 312.30336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)N2C3=NC(=O)C(=C(C3=C(N2)C)C)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=NC=N1)N2C3=NC(=O)C(=C(C3=C(N2)C)C)CC(=O)[O-]

InChI

InChI=1S/C15H15N5O3/c1-7-4-11(17-6-16-7)20-14-13(9(3)19-20)8(2)10(5-12(21)22)15(23)18-14/h4,6,19H,5H2,1-3H3,(H,21,22)/p-1