(2S)-2-methyl-3-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: (2S)-2-methyl-3-(phenylmethylsulfanyl)propanoic acid Openeye Name: (2S)-3-benzylsulfanyl-2-methyl-propanoic acid CAS Name: (2S)-2-methyl-3-(phenylmethylthio)propanoic acid IUPAC Name: (2S)-3-benzylsulfanyl-2-methylpropanoic acid Traditional Name: (2S)-3-(benzylthio)-2-methyl-propionic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

C[C@H](CSCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C11H14O2S/c1-9(11(12)13)7-14-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13)/t9-/m1/s1