(2S)-N-[2-(2-methoxyphenoxy)ethyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-N-[2-(2-methoxyphenoxy)ethyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-N-[2-(2-methoxyphenoxy)ethyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-N-[2-(2-methoxyphenoxy)ethyl]-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-N-[2-(2-methoxyphenoxy)ethyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-[2-(2-methoxyphenoxy)ethyl]-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC=C1OCCNC(=O)[C@H](CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O5S/c1-27-19-10-6-7-11-20(19)28-14-13-23-22(26)18(12-15-30-2)24-21(25)16-29-17-8-4-3-5-9-17/h3-11,18H,12-16H2,1-2H3,(H,23,26)(H,24,25)/t18-/m0/s1