6-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-3-methyl-2-sulfanylidene-3-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)hexanoic acid

Systemtic Name: 6-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-3-methyl-2-sulfanylidene-3-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)hexanoic acid Openeye Name: 6-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-3-methyl-2-thioxo-3-(1-thioxo-1,3,4-thiadiazol-2-yl)hexanoic acid CAS Name: 6-(4-acetyl-3-hydroxy-2-propylphenoxy)-3-methyl-2-sulfanylidene-3-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)hexanoic acid IUPAC Name: 6-(4-acetyl-3-hydroxy-2-propylphenoxy)-3-methyl-2-sulfanylidene-3-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)hexanoic acid Traditional Name: 6-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-3-methyl-2-thioxo-3-(1-thioxo-1,3,4-thiadiazol-2-yl)hexanoic acid Formula: C20H24N2O5S3 MolecularWeight: 468.60996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC(C)(C2=NN=CS2=S)C(=S)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC(C)(C2=NN=CS2=S)C(=S)C(=O)O

InChI

InChI=1S/C20H24N2O5S3/c1-4-6-14-15(8-7-13(12(2)23)16(14)24)27-10-5-9-20(3,17(28)18(25)26)19-22-21-11-30(19)29/h7-8,11,24H,4-6,9-10H2,1-3H3,(H,25,26)