1-[2,2-bis(fluoranyl)-2-methylsulfanyl-ethyl]adamantane

Systemtic Name: 1-[2,2-bis(fluoranyl)-2-methylsulfanyl-ethyl]adamantane Openeye Name: 1-(2,2-difluoro-2-methylsulfanyl-ethyl)adamantane CAS Name: 1-[2,2-difluoro-2-(methylthio)ethyl]adamantane IUPAC Name: 1-(2,2-difluoro-2-methylsulfanylethyl)adamantane Traditional Name: 1-[2,2-difluoro-2-(methylthio)ethyl]adamantane Formula: C13H20F2S MolecularWeight: 246.359706

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC12CC3CC(C1)CC(C3)C2)(F)F

Isomeric SMILES

CSC(CC12CC3CC(C1)CC(C3)C2)(F)F

InChI

InChI=1S/C13H20F2S/c1-16-13(14,15)8-12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-8H2,1H3