[(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-phenyl-methyl] ethanoate

Systemtic Name: [(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-phenyl-methyl] ethanoate Openeye Name: [(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-phenyl-methyl] acetate CAS Name: acetic acid [(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-phenylmethyl] ester IUPAC Name: [(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-phenylmethyl] acetate Traditional Name: acetic acid [(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-phenyl-methyl] ester Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C(C3=CC=CC=C3)OC(=O)C)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C(C3=CC=CC=C3)OC(=O)C)C

InChI

InChI=1S/C18H20N4O3/c1-4-8-13-14-15(22(3)21-13)18(24)20-17(19-14)16(25-11(2)23)12-9-6-5-7-10-12/h5-7,9-10,16H,4,8H2,1-3H3,(H,19,20,24)