methyl 2-[(4-oxidanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(4-oxidanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetate CAS Name: 2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetate Traditional Name: 2-[(4-keto-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)thio]acetic acid methyl ester Formula: C8H8N4O3S MolecularWeight: 240.23912

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=O)C2=CNNC2=N1

Isomeric SMILES

COC(=O)CSC1=NC(=O)C2=CNNC2=N1

InChI

InChI=1S/C8H8N4O3S/c1-15-5(13)3-16-8-10-6-4(2-9-12-6)7(14)11-8/h2H,3H2,1H3,(H2,9,10,11,12,14)