3-ethanoylsulfanyl-5-phenyl-2-(phenylmethyl)pentanoic acid

Systemtic Name: 3-ethanoylsulfanyl-5-phenyl-2-(phenylmethyl)pentanoic acid Openeye Name: 3-acetylsulfanyl-2-benzyl-5-phenyl-pentanoic acid CAS Name: 3-(acetylthio)-5-phenyl-2-(phenylmethyl)pentanoic acid IUPAC Name: 3-acetylsulfanyl-2-benzyl-5-phenylpentanoic acid Traditional Name: 3-(acetylthio)-2-benzyl-5-phenyl-valeric acid Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC1=CC=CC=C1)C(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(=O)SC(CCC1=CC=CC=C1)C(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H22O3S/c1-15(21)24-19(13-12-16-8-4-2-5-9-16)18(20(22)23)14-17-10-6-3-7-11-17/h2-11,18-19H,12-14H2,1H3,(H,22,23)