(2S)-2-acetamido-N-[(3S)-1-fluoranyl-5-methylsulfanyl-2-oxidanylidene-pentan-3-yl]-4-methyl-pentanamide

Systemtic Name: (2S)-2-acetamido-N-[(3S)-1-fluoranyl-5-methylsulfanyl-2-oxidanylidene-pentan-3-yl]-4-methyl-pentanamide Openeye Name: (2S)-2-acetamido-N-[(1S)-3-fluoro-1-(2-methylsulfanylethyl)-2-oxo-propyl]-4-methyl-pentanamide CAS Name: (2S)-2-acetamido-N-[(3S)-1-fluoro-5-(methylthio)-2-oxopentan-3-yl]-4-methylpentanamide IUPAC Name: (2S)-2-acetamido-N-[(3S)-1-fluoro-5-methylsulfanyl-2-oxopentan-3-yl]-4-methylpentanamide Traditional Name: (2S)-2-acetamido-N-[(1S)-3-fluoro-2-keto-1-[2-(methylthio)ethyl]propyl]-4-methyl-valeramide Formula: C14H25FN2O3S MolecularWeight: 320.423303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCSC)C(=O)CF)NC(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)CF)NC(=O)C

InChI

InChI=1S/C14H25FN2O3S/c1-9(2)7-12(16-10(3)18)14(20)17-11(5-6-21-4)13(19)8-15/h9,11-12H,5-8H2,1-4H3,(H,16,18)(H,17,20)/t11-,12-/m0/s1