N-(2-phenylsulfanylethyl)-7-(phenylsulfonylamino)heptanamide

Systemtic Name: N-(2-phenylsulfanylethyl)-7-(phenylsulfonylamino)heptanamide Openeye Name: 7-(benzenesulfonamido)-N-(2-phenylsulfanylethyl)heptanamide CAS Name: 7-(benzenesulfonamido)-N-[2-(phenylthio)ethyl]heptanamide IUPAC Name: 7-(benzenesulfonamido)-N-(2-phenylsulfanylethyl)heptanamide Traditional Name: 7-(benzenesulfonamido)-N-[2-(phenylthio)ethyl]enanthamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)CCCCCCNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)CCCCCCNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H28N2O3S2/c24-21(22-17-18-27-19-11-5-3-6-12-19)15-9-1-2-10-16-23-28(25,26)20-13-7-4-8-14-20/h3-8,11-14,23H,1-2,9-10,15-18H2,(H,22,24)