N-[4-[4-(octanoylamino)phenyl]sulfonylsulfanylphenyl]octanamide

Systemtic Name: N-[4-[4-(octanoylamino)phenyl]sulfonylsulfanylphenyl]octanamide Openeye Name: N-[4-[4-(octanoylamino)phenyl]sulfonylsulfanylphenyl]octanamide CAS Name: N-[4-[[4-(1-oxooctylamino)phenyl]sulfonylthio]phenyl]octanamide IUPAC Name: N-[4-[4-(octanoylamino)phenyl]sulfonylsulfanylphenyl]octanamide Traditional Name: N-[4-[[4-(caprylylamino)phenyl]sulfonylthio]phenyl]caprylamide Formula: C28H40N2O4S2 MolecularWeight: 532.7582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC=C(C=C1)SS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)NC1=CC=C(C=C1)SS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCCCCC

InChI

InChI=1S/C28H40N2O4S2/c1-3-5-7-9-11-13-27(31)29-23-15-19-25(20-16-23)35-36(33,34)26-21-17-24(18-22-26)30-28(32)14-12-10-8-6-4-2/h15-22H,3-14H2,1-2H3,(H,29,31)(H,30,32)