4-fluoranyl-3-[(4-propan-2-ylphenyl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[(4-propan-2-ylphenyl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[(4-isopropylphenyl)sulfanylmethyl]benzonitrile CAS Name: 4-fluoro-3-[[(4-propan-2-ylphenyl)thio]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[(4-propan-2-ylphenyl)sulfanylmethyl]benzonitrile Traditional Name: 4-fluoro-3-[(p-cumenylthio)methyl]benzonitrile Formula: C17H16FNS MolecularWeight: 285.379043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SCC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C17H16FNS/c1-12(2)14-4-6-16(7-5-14)20-11-15-9-13(10-19)3-8-17(15)18/h3-9,12H,11H2,1-2H3