(2S)-N-(3-fluoranyl-4-methyl-phenyl)-4-methylsulfanyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

Systemtic Name: (2S)-N-(3-fluoranyl-4-methyl-phenyl)-4-methylsulfanyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-4-methylsulfanyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: (2S)-N-(3-fluoro-4-methylphenyl)-4-(methylthio)-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: (2S)-N-(3-fluoro-4-methylphenyl)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-(1-ketoisoindolin-2-yl)-4-(methylthio)butyramide Formula: C20H21FN2O2S MolecularWeight: 372.456343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(CCSC)N2CC3=CC=CC=C3C2=O)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CCSC)N2CC3=CC=CC=C3C2=O)F

InChI

InChI=1S/C20H21FN2O2S/c1-13-7-8-15(11-17(13)21)22-19(24)18(9-10-26-2)23-12-14-5-3-4-6-16(14)20(23)25/h3-8,11,18H,9-10,12H2,1-2H3,(H,22,24)/t18-/m0/s1