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

Systemtic Name: N-(3-fluorophenyl)-2-[(4-oxidanylidene-1-pyridin-2-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[[4-oxo-1-(2-pyridyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: N-(3-fluorophenyl)-2-[[4-oxo-1-(2-pyridinyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[(4-oxo-1-pyridin-2-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[[4-keto-1-(2-pyridyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide Formula: C18H13FN6O2S MolecularWeight: 396.398223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=NC(=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C18H13FN6O2S/c19-11-4-3-5-12(8-11)22-15(26)10-28-18-23-16-13(17(27)24-18)9-21-25(16)14-6-1-2-7-20-14/h1-9,21H,10H2,(H,22,26)