(2S)-2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[(3-acetylsulfanyl-2-methyl-propanoyl)amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[3-(acetylthio)-2-methyl-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[(3-acetylsulfanyl-2-methylpropanoyl)amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[3-(acetylthio)-2-methyl-propanoyl]amino]-4-methyl-valeric acid Formula: C12H21NO4S MolecularWeight: 275.36444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(C)CSC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C12H21NO4S/c1-7(2)5-10(12(16)17)13-11(15)8(3)6-18-9(4)14/h7-8,10H,5-6H2,1-4H3,(H,13,15)(H,16,17)/t8?,10-/m0/s1