4-methyl-N-[[(2R)-2-oxidanylheptyl]-oxidanylidene-phenyl-$l^{6}-sulfanylidene]benzenesulfonamide

Systemtic Name: 4-methyl-N-[[(2R)-2-oxidanylheptyl]-oxidanylidene-phenyl-$l^{6}-sulfanylidene]benzenesulfonamide Openeye Name: N-[[(2R)-2-hydroxyheptyl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methyl-benzenesulfonamide CAS Name: N-[[(2R)-2-hydroxyheptyl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide IUPAC Name: N-[[(2R)-2-hydroxyheptyl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide Traditional Name: N-[[(2R)-2-hydroxyheptyl]-keto-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide Formula: C20H27NO4S2 MolecularWeight: 409.56268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CS(=NS(=O)(=O)C1=CC=C(C=C1)C)(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCC[C@H](C[S@@](=NS(=O)(=O)C1=CC=C(C=C1)C)(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C20H27NO4S2/c1-3-4-6-9-18(22)16-26(23,19-10-7-5-8-11-19)21-27(24,25)20-14-12-17(2)13-15-20/h5,7-8,10-15,18,22H,3-4,6,9,16H2,1-2H3/t18-,26-/m1/s1