(2S)-2-(4-methylpentanoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-(4-methylpentanoylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-(4-methylpentanoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[(4-methyl-1-oxopentyl)amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-(4-methylpentanoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(4-methylpentanoylamino)-4-(methylthio)butyrate Formula: C11H20NO3S- MolecularWeight: 246.3464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H21NO3S/c1-8(2)4-5-10(13)12-9(11(14)15)6-7-16-3/h8-9H,4-7H2,1-3H3,(H,12,13)(H,14,15)/p-1/t9-/m0/s1