[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2R)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2R)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (2R)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: (2R)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (2R)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: (2R)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyric acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O6S/c1-18-17(24)20-15(22)11-26-16(23)13(8-9-27-2)19-14(21)10-25-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H,19,21)(H2,18,20,22,24)/t13-/m1/s1