(2S)-2-[[2-(ethanoylsulfanylmethyl)-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[[2-(ethanoylsulfanylmethyl)-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[[2-(acetylsulfanylmethyl)-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[2-[(acetylthio)methyl]-4-methyl-1-oxopentyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[2-(acetylsulfanylmethyl)-4-methylpentanoyl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[2-[(acetylthio)methyl]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid Formula: C15H27NO4S MolecularWeight: 317.44418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H27NO4S/c1-9(2)6-12(8-21-11(5)17)14(18)16-13(15(19)20)7-10(3)4/h9-10,12-13H,6-8H2,1-5H3,(H,16,18)(H,19,20)/t12?,13-/m0/s1