N-[[(2R,3S)-3-heptyloxiran-2-yl]-oxidanylidene-phenyl-$l^{6}-sulfanylidene]-4-methyl-benzenesulfonamide

Systemtic Name: N-[[(2R,3S)-3-heptyloxiran-2-yl]-oxidanylidene-phenyl-$l^{6}-sulfanylidene]-4-methyl-benzenesulfonamide Openeye Name: N-[[(2R,3S)-3-heptyloxiran-2-yl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methyl-benzenesulfonamide CAS Name: N-[[(2R,3S)-3-heptyl-2-oxiranyl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide IUPAC Name: N-[[(2R,3S)-3-heptyloxiran-2-yl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide Traditional Name: N-[[(2R,3S)-3-heptyloxiran-2-yl]-keto-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide Formula: C22H29NO4S2 MolecularWeight: 435.59996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(O1)S(=NS(=O)(=O)C2=CC=C(C=C2)C)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC[C@H]1[C@H](O1)[S@@](=NS(=O)(=O)C2=CC=C(C=C2)C)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H29NO4S2/c1-3-4-5-6-10-13-21-22(27-21)28(24,19-11-8-7-9-12-19)23-29(25,26)20-16-14-18(2)15-17-20/h7-9,11-12,14-17,21-22H,3-6,10,13H2,1-2H3/t21-,22+,28-/m0/s1