(3-methyl-4-propan-2-yl-phenyl) (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate

Systemtic Name: (3-methyl-4-propan-2-yl-phenyl) (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate Openeye Name: (4-isopropyl-3-methyl-phenyl) (2S)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanoic acid (3-methyl-4-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-4-propan-2-ylphenyl) (2S)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate Traditional Name: (2S)-4-(methylthio)-2-phthalimido-butyric acid (4-isopropyl-3-methyl-phenyl) ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C(CCSC)N2C(=O)C3=CC=CC=C3C2=O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)[C@H](CCSC)N2C(=O)C3=CC=CC=C3C2=O)C(C)C

InChI

InChI=1S/C23H25NO4S/c1-14(2)17-10-9-16(13-15(17)3)28-23(27)20(11-12-29-4)24-21(25)18-7-5-6-8-19(18)22(24)26/h5-10,13-14,20H,11-12H2,1-4H3/t20-/m0/s1