5-fluoranyl-N-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-fluoranyl-N-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-1-benzothiophene-2-carboxamide Openeye Name: 5-fluoro-N-(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)benzothiophene-2-carboxamide CAS Name: 5-fluoro-N-(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-fluoro-N-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)-1-benzothiophene-2-carboxamide Traditional Name: 5-fluoro-N-(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)benzothiophene-2-carboxamide Formula: C20H12FN5O2S MolecularWeight: 405.404983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)NC(=O)C4=CC5=C(S4)C=CC(=C5)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)NC(=O)C4=CC5=C(S4)C=CC(=C5)F

InChI

InChI=1S/C20H12FN5O2S/c21-13-6-7-16-12(8-13)9-17(29-16)19(27)24-25-11-22-18-15(20(25)28)10-23-26(18)14-4-2-1-3-5-14/h1-11H,(H,24,27)