N-[4-ethyl-2,6-bis(oxidanylidene)-3,5-bis(sulfanyl)heptan-4-yl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[4-ethyl-2,6-bis(oxidanylidene)-3,5-bis(sulfanyl)heptan-4-yl]-1-phenyl-methanesulfonamide Openeye Name: N-[1-ethyl-3-oxo-1-(2-oxo-1-sulfanyl-propyl)-2-sulfanyl-butyl]-1-phenyl-methanesulfonamide CAS Name: N-(4-ethyl-3,5-dimercapto-2,6-dioxoheptan-4-yl)-1-phenylmethanesulfonamide IUPAC Name: N-[4-ethyl-2,6-dioxo-3,5-bis(sulfanyl)heptan-4-yl]-1-phenylmethanesulfonamide Traditional Name: N-[1-ethyl-3-keto-1-(2-keto-1-mercapto-propyl)-2-mercapto-butyl]-1-phenyl-methanesulfonamide Formula: C16H23NO4S3 MolecularWeight: 389.55312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(=O)C)S)(C(C(=O)C)S)NS(=O)(=O)CC1=CC=CC=C1

Isomeric SMILES

CCC(C(C(=O)C)S)(C(C(=O)C)S)NS(=O)(=O)CC1=CC=CC=C1

InChI

InChI=1S/C16H23NO4S3/c1-4-16(14(22)11(2)18,15(23)12(3)19)17-24(20,21)10-13-8-6-5-7-9-13/h5-9,14-15,17,22-23H,4,10H2,1-3H3