(2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-N-(4-methylsulfonylphenyl)butanamide

Systemtic Name: (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-N-(4-methylsulfonylphenyl)butanamide Openeye Name: (2R)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-N-(4-methylsulfonylphenyl)butanamide CAS Name: (2R)-2-(1,3-dioxo-2-isoindolyl)-N-(4-methylsulfonylphenyl)-4-(methylthio)butanamide IUPAC Name: (2R)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanyl-N-(4-methylsulfonylphenyl)butanamide Traditional Name: (2R)-N-(4-mesylphenyl)-4-(methylthio)-2-phthalimido-butyramide Formula: C20H20N2O5S2 MolecularWeight: 432.5132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CSCC[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H20N2O5S2/c1-28-12-11-17(22-19(24)15-5-3-4-6-16(15)20(22)25)18(23)21-13-7-9-14(10-8-13)29(2,26)27/h3-10,17H,11-12H2,1-2H3,(H,21,23)/t17-/m1/s1