ethyl 4-[5-(1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-(1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)furan-2-yl]benzoate Openeye Name: ethyl 4-[5-(1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-2-furyl]benzoate CAS Name: 4-[5-(1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-(1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)furan-2-yl]benzoate Traditional Name: 4-[5-(7-keto-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-2-furyl]benzoic acid ethyl ester Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3=NC(=O)C4=C(N3)C=NN4C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3=NC(=O)C4=C(N3)C=NN4C

InChI

InChI=1S/C19H16N4O4/c1-3-26-19(25)12-6-4-11(5-7-12)14-8-9-15(27-14)17-21-13-10-20-23(2)16(13)18(24)22-17/h4-10H,3H2,1-2H3,(H,21,22,24)