(2R)-N-(4-ethylphenyl)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: (2R)-N-(4-ethylphenyl)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: (2R)-3-benzylsulfanyl-N-(4-ethylphenyl)-2-(1-oxoisoindolin-2-yl)propanamide CAS Name: (2R)-N-(4-ethylphenyl)-2-(3-oxo-1H-isoindol-2-yl)-3-(phenylmethylthio)propanamide IUPAC Name: (2R)-3-benzylsulfanyl-N-(4-ethylphenyl)-2-(3-oxo-1H-isoindol-2-yl)propanamide Traditional Name: (2R)-3-(benzylthio)-N-(4-ethylphenyl)-2-(1-ketoisoindolin-2-yl)propionamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(CSCC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](CSCC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H26N2O2S/c1-2-19-12-14-22(15-13-19)27-25(29)24(18-31-17-20-8-4-3-5-9-20)28-16-21-10-6-7-11-23(21)26(28)30/h3-15,24H,2,16-18H2,1H3,(H,27,29)/t24-/m0/s1