1-(3-fluoranyl-4-methoxy-phenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(3-fluoro-4-methoxyphenyl)-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]ethanone Formula: C15H13FN4O2S MolecularWeight: 332.352723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C15H13FN4O2S/c1-20-14-10(6-19-20)15(18-8-17-14)23-7-12(21)9-3-4-13(22-2)11(16)5-9/h3-6,8H,7H2,1-2H3