2-[4-[[5-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[[5-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[[5-[(4-acetyl-3-hydroxy-2-propyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenoxy]acetic acid CAS Name: 2-[4-[[[5-[(4-acetyl-3-hydroxy-2-propylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[[5-[(4-acetyl-3-hydroxy-2-propylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenoxy]acetic acid Traditional Name: 2-[4-[[[5-[(4-acetyl-3-hydroxy-2-propyl-benzyl)thio]-1,3,4-thiadiazol-2-yl]thio]methyl]phenoxy]acetic acid Formula: C23H24N2O5S3 MolecularWeight: 504.64206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)CSC2=NN=C(S2)SCC3=CC=C(C=C3)OCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)CSC2=NN=C(S2)SCC3=CC=C(C=C3)OCC(=O)O

InChI

InChI=1S/C23H24N2O5S3/c1-3-4-19-16(7-10-18(14(2)26)21(19)29)13-32-23-25-24-22(33-23)31-12-15-5-8-17(9-6-15)30-11-20(27)28/h5-10,29H,3-4,11-13H2,1-2H3,(H,27,28)