(2S)-2-(2,4,6-trimethylphenyl)sulfanylpropanoic acid

Systemtic Name: (2S)-2-(2,4,6-trimethylphenyl)sulfanylpropanoic acid Openeye Name: (2S)-2-(2,4,6-trimethylphenyl)sulfanylpropanoic acid CAS Name: (2S)-2-[(2,4,6-trimethylphenyl)thio]propanoic acid IUPAC Name: (2S)-2-(2,4,6-trimethylphenyl)sulfanylpropanoic acid Traditional Name: (2S)-2-(mesitylthio)propionic acid Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SC(C)C(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C12H16O2S/c1-7-5-8(2)11(9(3)6-7)15-10(4)12(13)14/h5-6,10H,1-4H3,(H,13,14)/t10-/m0/s1