(2S)-N-[(2-methoxyphenyl)methyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-N-[(2-methoxyphenyl)methyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-N-[(2-methoxyphenyl)methyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-N-[(2-methoxyphenyl)methyl]-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-N-[(2-methoxyphenyl)methyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-4-(methylthio)-N-o-anisyl-2-[(2-phenoxyacetyl)amino]butyramide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)[C@H](CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O4S/c1-26-19-11-7-6-8-16(19)14-22-21(25)18(12-13-28-2)23-20(24)15-27-17-9-4-3-5-10-17/h3-11,18H,12-15H2,1-2H3,(H,22,25)(H,23,24)/t18-/m0/s1