2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[1-(2-methoxyphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]ethanamide Openeye Name: 2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: 2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide IUPAC Name: 2-[[1-(2-methoxyphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide Traditional Name: 2-[[4-keto-1-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide Formula: C14H13N5O3S MolecularWeight: 331.34972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NC(=NC(=O)C3=CN2)SCC(=O)N

Isomeric SMILES

COC1=CC=CC=C1N2C3=NC(=NC(=O)C3=CN2)SCC(=O)N

InChI

InChI=1S/C14H13N5O3S/c1-22-10-5-3-2-4-9(10)19-12-8(6-16-19)13(21)18-14(17-12)23-7-11(15)20/h2-6,16H,7H2,1H3,(H2,15,20)