2-azanyl-N-[1-[2-(dioxidanyl)prop-2-enylsulfanyl]-6-methyl-7-oxidanyl-4-oxidanylidene-heptan-3-yl]butanediamide

Systemtic Name: 2-azanyl-N-[1-[2-(dioxidanyl)prop-2-enylsulfanyl]-6-methyl-7-oxidanyl-4-oxidanylidene-heptan-3-yl]butanediamide Openeye Name: 2-amino-N-[1-[2-(2-hydroperoxyallylsulfanyl)ethyl]-5-hydroxy-4-methyl-2-oxo-pentyl]butanediamide CAS Name: 2-amino-N-[1-(2-hydroperoxyprop-2-enylthio)-7-hydroxy-6-methyl-4-oxoheptan-3-yl]butanediamide IUPAC Name: 2-amino-N-[1-(2-hydroperoxyprop-2-enylsulfanyl)-7-hydroxy-6-methyl-4-oxoheptan-3-yl]butanediamide Traditional Name: 2-amino-N-[1-[2-(2-hydroperoxyallylthio)ethyl]-5-hydroxy-2-keto-4-methyl-pentyl]succinamide Formula: C15H27N3O6S MolecularWeight: 377.45638

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(CCSCC(=C)OO)NC(=O)C(CC(=O)N)N)CO

Isomeric SMILES

CC(CC(=O)C(CCSCC(=C)OO)NC(=O)C(CC(=O)N)N)CO

InChI

InChI=1S/C15H27N3O6S/c1-9(7-19)5-13(20)12(3-4-25-8-10(2)24-23)18-15(22)11(16)6-14(17)21/h9,11-12,19,23H,2-8,16H2,1H3,(H2,17,21)(H,18,22)