[(2R)-1-oxidanylidene-1-[[(2R)-2-phenylpropyl]amino]propan-2-yl] 4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[(2R)-2-phenylpropyl]amino]propan-2-yl] 4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-[[(2R)-2-phenylpropyl]amino]ethyl] 4-(4-methylsulfanylphenyl)-4-oxo-butanoate CAS Name: 4-[4-(methylthio)phenyl]-4-oxobutanoic acid [(2R)-1-oxo-1-[[(2R)-2-phenylpropyl]amino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[[(2R)-2-phenylpropyl]amino]propan-2-yl] 4-(4-methylsulfanylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-[4-(methylthio)phenyl]butyric acid [(1R)-2-keto-1-methyl-2-[[(2R)-2-phenylpropyl]amino]ethyl] ester Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)OC(=O)CCC(=O)C1=CC=C(C=C1)SC)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](CNC(=O)[C@@H](C)OC(=O)CCC(=O)C1=CC=C(C=C1)SC)C2=CC=CC=C2

InChI

InChI=1S/C23H27NO4S/c1-16(18-7-5-4-6-8-18)15-24-23(27)17(2)28-22(26)14-13-21(25)19-9-11-20(29-3)12-10-19/h4-12,16-17H,13-15H2,1-3H3,(H,24,27)/t16-,17+/m0/s1