4-methyl-2-[(4-phenyl-2-sulfanyl-butanoyl)amino]pentanoic acid

Systemtic Name: 4-methyl-2-[(4-phenyl-2-sulfanyl-butanoyl)amino]pentanoic acid Openeye Name: 4-methyl-2-[(4-phenyl-2-sulfanyl-butanoyl)amino]pentanoic acid CAS Name: 2-[(2-mercapto-1-oxo-4-phenylbutyl)amino]-4-methylpentanoic acid IUPAC Name: 4-methyl-2-[(4-phenyl-2-sulfanylbutanoyl)amino]pentanoic acid Traditional Name: 2-[(2-mercapto-4-phenyl-butanoyl)amino]-4-methyl-valeric acid Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CCC1=CC=CC=C1)S

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(CCC1=CC=CC=C1)S

InChI

InChI=1S/C16H23NO3S/c1-11(2)10-13(16(19)20)17-15(18)14(21)9-8-12-6-4-3-5-7-12/h3-7,11,13-14,21H,8-10H2,1-2H3,(H,17,18)(H,19,20)