2-[5-[2-(4-methylphenyl)sulfanylethanoyl]-2,5-dihydrothiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[2-(4-methylphenyl)sulfanylethanoyl]-2,5-dihydrothiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[2-(p-tolylsulfanyl)acetyl]-2,5-dihydrothiophen-2-yl]acetic acid CAS Name: 2-[5-[2-[(4-methylphenyl)thio]-1-oxoethyl]-2,5-dihydrothiophen-2-yl]acetic acid IUPAC Name: 2-[5-[2-(4-methylphenyl)sulfanylacetyl]-2,5-dihydrothiophen-2-yl]acetic acid Traditional Name: 2-[5-[2-(p-tolylthio)acetyl]-2,5-dihydrothiophen-2-yl]acetic acid Formula: C15H16O3S2 MolecularWeight: 308.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)C2C=CC(S2)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)C2C=CC(S2)CC(=O)O

InChI

InChI=1S/C15H16O3S2/c1-10-2-4-11(5-3-10)19-9-13(16)14-7-6-12(20-14)8-15(17)18/h2-7,12,14H,8-9H2,1H3,(H,17,18)