2-[(4-methylphenyl)sulfonylamino]-3-[[2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-3-[[2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid Openeye Name: 3-[[3-hydroxy-3-oxo-2-(p-tolylsulfonylamino)propyl]disulfanyl]-2-(p-tolylsulfonylamino)propanoic acid CAS Name: 3-[[3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-oxopropyl]disulfanyl]-2-[(4-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[[3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-oxopropyl]disulfanyl]-2-[(4-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[[3-hydroxy-3-keto-2-(tosylamino)propyl]disulfanyl]-2-(tosylamino)propionic acid Formula: C20H24N2O8S4 MolecularWeight: 548.67316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CSSCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CSSCC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)O

InChI

InChI=1S/C20H24N2O8S4/c1-13-3-7-15(8-4-13)33(27,28)21-17(19(23)24)11-31-32-12-18(20(25)26)22-34(29,30)16-9-5-14(2)6-10-16/h3-10,17-18,21-22H,11-12H2,1-2H3,(H,23,24)(H,25,26)