(2S)-2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[(3-acetylsulfanyl-2-methyl-propanoyl)amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[3-(acetylthio)-2-methyl-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(3-acetylsulfanyl-2-methylpropanoyl)amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[3-(acetylthio)-2-methyl-propanoyl]amino]-3-phenyl-propionic acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(CSC(=O)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C15H19NO4S/c1-10(9-21-11(2)17)14(18)16-13(15(19)20)8-12-6-4-3-5-7-12/h3-7,10,13H,8-9H2,1-2H3,(H,16,18)(H,19,20)/t10?,13-/m0/s1