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

Systemtic Name: methyl 5-[[(2S)-2-acetamido-4-methylsulfanyl-butanoyl]amino]-4-oxidanylidene-pentanoate Openeye Name: methyl 5-[[(2S)-2-acetamido-4-methylsulfanyl-butanoyl]amino]-4-oxo-pentanoate CAS Name: 5-[[(2S)-2-acetamido-4-(methylthio)-1-oxobutyl]amino]-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[(2S)-2-acetamido-4-methylsulfanylbutanoyl]amino]-4-oxopentanoate Traditional Name: 5-[[(2S)-2-acetamido-4-(methylthio)butanoyl]amino]-4-keto-valeric acid methyl ester Formula: C13H22N2O5S MolecularWeight: 318.38918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)NCC(=O)CCC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O5S/c1-9(16)15-11(6-7-21-3)13(19)14-8-10(17)4-5-12(18)20-2/h11H,4-8H2,1-3H3,(H,14,19)(H,15,16)/t11-/m0/s1