methyl (2R)-2-[[(3R)-3-acetamido-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[[(3R)-3-acetamido-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[(3R)-3-acetamido-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(3R)-3-acetamido-1-oxo-3-phenylpropyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(3R)-3-acetamido-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[(3R)-3-acetamido-3-phenyl-propanoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC(CCSC)C(=O)OC)C1=CC=CC=C1

Isomeric SMILES

CC(=O)N[C@H](CC(=O)N[C@H](CCSC)C(=O)OC)C1=CC=CC=C1

InChI

InChI=1S/C17H24N2O4S/c1-12(20)18-15(13-7-5-4-6-8-13)11-16(21)19-14(9-10-24-3)17(22)23-2/h4-8,14-15H,9-11H2,1-3H3,(H,18,20)(H,19,21)/t14-,15-/m1/s1