3-[3,4-bis(fluoranyl)phenyl]sulfanylpropanamide

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]sulfanylpropanamide Openeye Name: 3-(3,4-difluorophenyl)sulfanylpropanamide CAS Name: 3-[(3,4-difluorophenyl)thio]propanamide IUPAC Name: 3-(3,4-difluorophenyl)sulfanylpropanamide Traditional Name: 3-[(3,4-difluorophenyl)thio]propionamide Formula: C9H9F2NOS MolecularWeight: 217.235666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCCC(=O)N)F)F

Isomeric SMILES

C1=CC(=C(C=C1SCCC(=O)N)F)F

InChI

InChI=1S/C9H9F2NOS/c10-7-2-1-6(5-8(7)11)14-4-3-9(12)13/h1-2,5H,3-4H2,(H2,12,13)