methyl (2S)-2-(5-chloranylpentanoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-(5-chloranylpentanoylamino)-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-(5-chloropentanoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[(5-chloro-1-oxopentyl)amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-(5-chloropentanoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(5-chloropentanoylamino)-4-(methylthio)butyric acid methyl ester Formula: C11H20ClNO3S MolecularWeight: 281.7994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)CCCCCl

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)CCCCCl

InChI

InChI=1S/C11H20ClNO3S/c1-16-11(15)9(6-8-17-2)13-10(14)5-3-4-7-12/h9H,3-8H2,1-2H3,(H,13,14)/t9-/m0/s1