(2S)-2-azanyl-3-methyl-4-(phenylmethylsulfanyl)pentanoic acid

Systemtic Name: (2S)-2-azanyl-3-methyl-4-(phenylmethylsulfanyl)pentanoic acid Openeye Name: (2S)-2-amino-4-benzylsulfanyl-3-methyl-pentanoic acid CAS Name: (2S)-2-amino-3-methyl-4-(phenylmethylthio)pentanoic acid IUPAC Name: (2S)-2-amino-4-benzylsulfanyl-3-methylpentanoic acid Traditional Name: (2S)-2-amino-4-(benzylthio)-3-methyl-valeric acid Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)SCC1=CC=CC=C1)C(C(=O)O)N

Isomeric SMILES

CC([C@@H](C(=O)O)N)C(C)SCC1=CC=CC=C1

InChI

InChI=1S/C13H19NO2S/c1-9(12(14)13(15)16)10(2)17-8-11-6-4-3-5-7-11/h3-7,9-10,12H,8,14H2,1-2H3,(H,15,16)/t9?,10?,12-/m0/s1