(2S)-3-methyl-2-[(2-methyl-3-sulfanyl-propanoyl)amino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(2-methyl-3-sulfanyl-propanoyl)amino]butanoic acid Openeye Name: (2S)-3-methyl-2-[(2-methyl-3-sulfanyl-propanoyl)amino]butanoic acid CAS Name: (2S)-2-[(3-mercapto-2-methyl-1-oxopropyl)amino]-3-methylbutanoic acid IUPAC Name: (2S)-3-methyl-2-[(2-methyl-3-sulfanylpropanoyl)amino]butanoic acid Traditional Name: (2S)-2-[(3-mercapto-2-methyl-propanoyl)amino]-3-methyl-butyric acid Formula: C9H17NO3S MolecularWeight: 219.30118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(C)CS

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C(C)CS

InChI

InChI=1S/C9H17NO3S/c1-5(2)7(9(12)13)10-8(11)6(3)4-14/h5-7,14H,4H2,1-3H3,(H,10,11)(H,12,13)/t6?,7-/m0/s1