(2S)-4-methylsulfanyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-N-(1-thiophen-2-ylethyl)butanamide

Systemtic Name: (2S)-4-methylsulfanyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-N-(1-thiophen-2-ylethyl)butanamide Openeye Name: (2S)-4-methylsulfanyl-2-(1-oxoisoindolin-2-yl)-N-[1-(2-thienyl)ethyl]butanamide CAS Name: (2S)-4-(methylthio)-2-(3-oxo-1H-isoindol-2-yl)-N-(1-thiophen-2-ylethyl)butanamide IUPAC Name: (2S)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)-N-(1-thiophen-2-ylethyl)butanamide Traditional Name: (2S)-2-(1-ketoisoindolin-2-yl)-4-(methylthio)-N-[1-(2-thienyl)ethyl]butyramide Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C(CCSC)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)[C@H](CCSC)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H22N2O2S2/c1-13(17-8-5-10-25-17)20-18(22)16(9-11-24-2)21-12-14-6-3-4-7-15(14)19(21)23/h3-8,10,13,16H,9,11-12H2,1-2H3,(H,20,22)/t13?,16-/m0/s1