(2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-ethyl-6-methyl-phenyl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-ethyl-6-methyl-phenyl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-(1,3-dioxoisoindolin-2-yl)-N-(2-ethyl-6-methyl-phenyl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-N-(2-ethyl-6-methylphenyl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-(1,3-dioxoisoindol-2-yl)-N-(2-ethyl-6-methylphenyl)-4-methylsulfanylbutanamide Traditional Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-4-(methylthio)-2-phthalimido-butyramide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(CCSC)N2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)[C@H](CCSC)N2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C22H24N2O3S/c1-4-15-9-7-8-14(2)19(15)23-20(25)18(12-13-28-3)24-21(26)16-10-5-6-11-17(16)22(24)27/h5-11,18H,4,12-13H2,1-3H3,(H,23,25)/t18-/m0/s1