(2R)-N-[(4-methoxyphenyl)methyl]-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: (2R)-N-[(4-methoxyphenyl)methyl]-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: (2R)-3-benzylsulfanyl-N-[(4-methoxyphenyl)methyl]-2-(1-oxoisoindolin-2-yl)propanamide CAS Name: (2R)-N-[(4-methoxyphenyl)methyl]-2-(3-oxo-1H-isoindol-2-yl)-3-(phenylmethylthio)propanamide IUPAC Name: (2R)-3-benzylsulfanyl-N-[(4-methoxyphenyl)methyl]-2-(3-oxo-1H-isoindol-2-yl)propanamide Traditional Name: (2R)-3-(benzylthio)-2-(1-ketoisoindolin-2-yl)-N-p-anisyl-propionamide Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(CSCC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)[C@H](CSCC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H26N2O3S/c1-31-22-13-11-19(12-14-22)15-27-25(29)24(18-32-17-20-7-3-2-4-8-20)28-16-21-9-5-6-10-23(21)26(28)30/h2-14,24H,15-18H2,1H3,(H,27,29)/t24-/m0/s1