[3-(3-ethynyl-5-fluoranyl-phenyl)-5-(3-ethynylsulfanylphenyl)-4-oxidanylidene-pyridin-1-yl] ethanoate

Systemtic Name: [3-(3-ethynyl-5-fluoranyl-phenyl)-5-(3-ethynylsulfanylphenyl)-4-oxidanylidene-pyridin-1-yl] ethanoate Openeye Name: [3-(3-ethynyl-5-fluoro-phenyl)-5-(3-ethynylsulfanylphenyl)-4-oxo-1-pyridyl] acetate CAS Name: acetic acid [3-(3-ethynyl-5-fluorophenyl)-5-[3-(ethynylthio)phenyl]-4-oxo-1-pyridinyl] ester IUPAC Name: [3-(3-ethynyl-5-fluorophenyl)-5-(3-ethynylsulfanylphenyl)-4-oxopyridin-1-yl] acetate Traditional Name: acetic acid [3-(3-ethynyl-5-fluoro-phenyl)-5-[3-(ethynylthio)phenyl]-4-keto-1-pyridyl] ester Formula: C23H14FNO3S MolecularWeight: 403.425563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1C=C(C(=O)C(=C1)C2=CC(=CC(=C2)C#C)F)C3=CC(=CC=C3)SC#C

Isomeric SMILES

CC(=O)ON1C=C(C(=O)C(=C1)C2=CC(=CC(=C2)C#C)F)C3=CC(=CC=C3)SC#C

InChI

InChI=1S/C23H14FNO3S/c1-4-16-9-18(11-19(24)10-16)22-14-25(28-15(3)26)13-21(23(22)27)17-7-6-8-20(12-17)29-5-2/h1-2,6-14H,3H3