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

Systemtic Name: methyl 2-methyl-5-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 5-[[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C19H16N4O4S/c1-11-14(18(25)26-2)8-13(27-11)10-28-19-21-16-15(17(24)22-19)9-20-23(16)12-6-4-3-5-7-12/h3-9,20H,10H2,1-2H3