methyl 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoate

Systemtic Name: methyl 3-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoate Openeye Name: methyl 3-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propyl]-4-ethyl-2-methyl-5-thioxo-1,3-dithiolan-2-yl]propanoate CAS Name: 3-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propyl]-4-ethyl-2-methyl-5-sulfanylidene-1,3-dithiolan-2-yl]propanoate Traditional Name: 3-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propyl]-4-ethyl-2-methyl-5-thioxo-1,3-dithiolan-2-yl]propionic acid methyl ester Formula: C24H34O5S3 MolecularWeight: 498.71876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC2(C(=S)SC(S2)(C)CCC(=O)OC)CC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC2(C(=S)SC(S2)(C)CCC(=O)OC)CC

InChI

InChI=1S/C24H34O5S3/c1-6-9-18-19(11-10-17(16(3)25)21(18)27)29-15-8-13-24(7-2)22(30)31-23(4,32-24)14-12-20(26)28-5/h10-11,27H,6-9,12-15H2,1-5H3