(2S)-2-(2,4-dimethylphenyl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: (2S)-2-(2,4-dimethylphenyl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: (2S)-2-(2,4-dimethylphenyl)sulfanyl-2-phenyl-acetic acid CAS Name: (2S)-2-[(2,4-dimethylphenyl)thio]-2-phenylacetic acid IUPAC Name: (2S)-2-(2,4-dimethylphenyl)sulfanyl-2-phenylacetic acid Traditional Name: (2S)-2-[(2,4-dimethylphenyl)thio]-2-phenyl-acetic acid Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC(C2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)S[C@@H](C2=CC=CC=C2)C(=O)O)C

InChI

InChI=1S/C16H16O2S/c1-11-8-9-14(12(2)10-11)19-15(16(17)18)13-6-4-3-5-7-13/h3-10,15H,1-2H3,(H,17,18)/t15-/m0/s1