(2R)-4-methyl-2-[[(2S)-3-phenyl-2-(2-sulfanylethylamino)propanoyl]amino]pentanoic acid

Systemtic Name: (2R)-4-methyl-2-[[(2S)-3-phenyl-2-(2-sulfanylethylamino)propanoyl]amino]pentanoic acid Openeye Name: (2R)-4-methyl-2-[[(2S)-3-phenyl-2-(2-sulfanylethylamino)propanoyl]amino]pentanoic acid CAS Name: (2R)-2-[[(2S)-2-(2-mercaptoethylamino)-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid IUPAC Name: (2R)-4-methyl-2-[[(2S)-3-phenyl-2-(2-sulfanylethylamino)propanoyl]amino]pentanoic acid Traditional Name: (2R)-2-[[(2S)-2-(2-mercaptoethylamino)-3-phenyl-propanoyl]amino]-4-methyl-valeric acid Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NCCS

Isomeric SMILES

CC(C)C[C@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NCCS

InChI

InChI=1S/C17H26N2O3S/c1-12(2)10-15(17(21)22)19-16(20)14(18-8-9-23)11-13-6-4-3-5-7-13/h3-7,12,14-15,18,23H,8-11H2,1-2H3,(H,19,20)(H,21,22)/t14-,15+/m0/s1