(2S)-3-methyl-N-(3-methylsulfonylphenyl)-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-(3-methylsulfonylphenyl)-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-3-methyl-N-(3-methylsulfonylphenyl)-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-3-methyl-N-(3-methylsulfonylphenyl)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-3-methyl-N-(3-methylsulfonylphenyl)-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-(3-mesylphenyl)-3-methyl-2-[(2-phenoxyacetyl)amino]butyramide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)C)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)C)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O5S/c1-14(2)19(22-18(23)13-27-16-9-5-4-6-10-16)20(24)21-15-8-7-11-17(12-15)28(3,25)26/h4-12,14,19H,13H2,1-3H3,(H,21,24)(H,22,23)/t19-/m0/s1