methyl (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-4-(methylthio)butyric acid methyl ester Formula: C18H24FNO4S2 MolecularWeight: 400.518398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)C#CCCCCF

Isomeric SMILES

COC(=O)[C@@H](CCSC)NS(=O)(=O)C1=CC=C(C=C1)C#CCCCC[18F]

InChI

InChI=1S/C18H24FNO4S2/c1-24-18(21)17(12-14-25-2)20-26(22,23)16-10-8-15(9-11-16)7-5-3-4-6-13-19/h8-11,17,20H,3-4,6,12-14H2,1-2H3/t17-/m1/s1/i19-1