ethyl 5-[[1-(4-methylphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[[1-(4-methylphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: ethyl 5-[[4-oxo-1-(p-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[1-(4-methylphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]methyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(4-methylphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[4-keto-1-(p-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]methyl]furan-2-carboxylic acid ethyl ester Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=C(C=C4)C

InChI

InChI=1S/C20H18N4O4S/c1-3-27-19(26)16-9-8-14(28-16)11-29-20-22-17-15(18(25)23-20)10-21-24(17)13-6-4-12(2)5-7-13/h4-10,21H,3,11H2,1-2H3