(2S)-2-(2-methylpropanoylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-(2-methylpropanoylamino)-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-(2-methylpropanoylamino)-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[(2-methyl-1-oxopropyl)amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-(2-methylpropanoylamino)-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-(isobutyrylamino)-4-(methylthio)butyric acid Formula: C9H17NO3S MolecularWeight: 219.30118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO3S/c1-6(2)8(11)10-7(9(12)13)4-5-14-3/h6-7H,4-5H2,1-3H3,(H,10,11)(H,12,13)/t7-/m0/s1