(3,3-dimethyl-2-oxidanylidene-butyl) (2S)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) (2S)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) (2S)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) (2S)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyric acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C(CCSC)NC(=O)COC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)[C@H](CCSC)NC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C19H27NO5S/c1-19(2,3)16(21)12-25-18(23)15(10-11-26-4)20-17(22)13-24-14-8-6-5-7-9-14/h5-9,15H,10-13H2,1-4H3,(H,20,22)/t15-/m0/s1