4-[2-[3,4-bis(fluoranyl)phenyl]sulfanylethanoyl]benzenecarbonitrile

Systemtic Name: 4-[2-[3,4-bis(fluoranyl)phenyl]sulfanylethanoyl]benzenecarbonitrile Openeye Name: 4-[2-(3,4-difluorophenyl)sulfanylacetyl]benzonitrile CAS Name: 4-[2-[(3,4-difluorophenyl)thio]-1-oxoethyl]benzonitrile IUPAC Name: 4-[2-(3,4-difluorophenyl)sulfanylacetyl]benzonitrile Traditional Name: 4-[2-[(3,4-difluorophenyl)thio]acetyl]benzonitrile Formula: C15H9F2NOS MolecularWeight: 289.299866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)CSC2=CC(=C(C=C2)F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)CSC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C15H9F2NOS/c16-13-6-5-12(7-14(13)17)20-9-15(19)11-3-1-10(8-18)2-4-11/h1-7H,9H2