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

Systemtic Name: 3-fluoranyl-4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-fluoro-4-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-fluoro-4-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]benzonitrile Formula: C13H10FN3OS MolecularWeight: 275.301403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C13H10FN3OS/c1-8-4-12(18)17-13(16-8)19-7-10-3-2-9(6-15)5-11(10)14/h2-5H,7H2,1H3,(H,16,17,18)