4-methyl-N-[2-[[(4-methylphenyl)sulfonylamino]methyl]-13-oxidanyl-tridecyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[[(4-methylphenyl)sulfonylamino]methyl]-13-oxidanyl-tridecyl]benzenesulfonamide Openeye Name: N-[13-hydroxy-2-[(p-tolylsulfonylamino)methyl]tridecyl]-4-methyl-benzenesulfonamide CAS Name: N-[13-hydroxy-2-[[(4-methylphenyl)sulfonylamino]methyl]tridecyl]-4-methylbenzenesulfonamide IUPAC Name: N-[13-hydroxy-2-[[(4-methylphenyl)sulfonylamino]methyl]tridecyl]-4-methylbenzenesulfonamide Traditional Name: N-[13-hydroxy-2-[(tosylamino)methyl]tridecyl]-4-methyl-benzenesulfonamide Formula: C28H44N2O5S2 MolecularWeight: 552.78936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(CCCCCCCCCCCO)CNS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(CCCCCCCCCCCO)CNS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C28H44N2O5S2/c1-24-13-17-27(18-14-24)36(32,33)29-22-26(12-10-8-6-4-3-5-7-9-11-21-31)23-30-37(34,35)28-19-15-25(2)16-20-28/h13-20,26,29-31H,3-12,21-23H2,1-2H3