methyl 3-[(2-acetamido-4-methylsulfanyl-butanoyl)amino]-5-fluoranyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl 3-[(2-acetamido-4-methylsulfanyl-butanoyl)amino]-5-fluoranyl-4-oxidanylidene-pentanoate Openeye Name: methyl 3-[(2-acetamido-4-methylsulfanyl-butanoyl)amino]-5-fluoro-4-oxo-pentanoate CAS Name: 3-[[2-acetamido-4-(methylthio)-1-oxobutyl]amino]-5-fluoro-4-oxopentanoic acid methyl ester IUPAC Name: methyl 3-[(2-acetamido-4-methylsulfanylbutanoyl)amino]-5-fluoro-4-oxopentanoate Traditional Name: 3-[[2-acetamido-4-(methylthio)butanoyl]amino]-5-fluoro-4-keto-valeric acid methyl ester Formula: C13H21FN2O5S MolecularWeight: 336.379643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21FN2O5S/c1-8(17)15-9(4-5-22-3)13(20)16-10(11(18)7-14)6-12(19)21-2/h9-10H,4-7H2,1-3H3,(H,15,17)(H,16,20)