2-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(1-cyanocyclohexyl)-N-methyl-ethanamide

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(1-cyanocyclohexyl)-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(3,4-difluorophenyl)sulfanyl-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[(3,4-difluorophenyl)thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(3,4-difluorophenyl)sulfanyl-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(3,4-difluorophenyl)thio]-N-methyl-acetamide Formula: C16H18F2N2OS MolecularWeight: 324.388726

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=CC(=C(C=C1)F)F)C2(CCCCC2)C#N

Isomeric SMILES

CN(C(=O)CSC1=CC(=C(C=C1)F)F)C2(CCCCC2)C#N

InChI

InChI=1S/C16H18F2N2OS/c1-20(16(11-19)7-3-2-4-8-16)15(21)10-22-12-5-6-13(17)14(18)9-12/h5-6,9H,2-4,7-8,10H2,1H3