3-fluoranyl-4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]benzonitrile CAS Name: 3-fluoro-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]benzonitrile IUPAC Name: 3-fluoro-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]benzonitrile Traditional Name: 3-fluoro-4-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]benzonitrile Formula: C12H8FN3OS MolecularWeight: 261.274823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C12H8FN3OS/c1-7-4-11(17)16-12(15-7)18-10-3-2-8(6-14)5-9(10)13/h2-5H,1H3,(H,15,16,17)